SCHEMBL2315033

SCHEMBL2315033

CC(=O)NCCc1ccc(B(O)O)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.66
F13A1 P00488 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.60
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
HPGD P15428 1/20 0.56
PTGS1 P23219 1/20 0.56
BLM P54132 1/20 0.56
HIF1A Q16665 1/20 0.56
HSD17B10 Q99714 1/20 0.56
LPL P06858 3/20 0.53
LIPG Q9Y5X9 3/20 0.53
ACACB O00763 3/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
TRPV1 Q8NER1 4/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10592850 0.87 KDM4E (0.84) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL14756882 0.84 KDM4E (0.55) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL101621 0.81 KMT2A (0.59) ALDH1A1MAPTLPLLIPGTRPV1
SCHEMBL5237478 0.80 LPL (0.54) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL661278 0.79 KDM4E (0.72) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL734658 0.79 KDM4E (1.00) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL6845396 0.79 KDM4E (0.72) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL2093513 0.79 KDM4E (0.72) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL11553305 0.79 KDM4E (0.72) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA
SCHEMBL5987671 0.79 KDM4E (0.72) KDM4EF13A1SMN1; SMN2ALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11560386-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2023-01-24 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-3464292-B1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2022-09-21 EP disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
US-20210340154-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2021-11-04 US disclosed
US-10927123-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2021-02-23 US disclosed
US-20200270264-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2020-08-27 US disclosed
US-10662200-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2020-05-26 US disclosed
US-10479797-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2019-11-19 US disclosed
US-20190292196-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2019-09-26 US disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
WO-2017214002-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2017-12-14 WO disclosed
US-9834521-B2 Choline kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20160024024-A1 Novel Choline Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. 2016-01-28 US disclosed
EP-2968358-A1 NOVEL CHOLINE KINASE INHIBITORS ARIAD Pharmaceuticals, Inc. (US) 2016-01-20 EP disclosed
US-20140349970-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2014-11-27 US disclosed
WO-2014151761-A1 NOVEL CHOLINE KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2014-09-25 WO disclosed
US-8785639-B2 Substituted dihydropyrazolo[3,4-D]pyrrolo[2,3-B]pyridines and methods of use thereof ABBVIE INC. (US) 2014-07-22 US disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
US-20110190489-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-08-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10479797-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ADRB3, ADRB1, ADRB2 KDM4E 4669/4885F13A1 1751/4885SMN1; SMN2 4018/4885
US-20160024024-A1 Novel Choline Kinase Inhibitors CHKA, CHKB, CEPT1 KDM4E 1264/4885F13A1 3338/4885SMN1; SMN2 2555/4885
US-20190292196-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ADRB3, ADRB1, ADRB2 KDM4E 4669/4885F13A1 1751/4885SMN1; SMN2 4018/4885
US-20210340154-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ADRB3, ADRB1, ADRB2 KDM4E 4666/4885F13A1 1853/4885SMN1; SMN2 4006/4885
US-20140349970-A1 NOVEL TRICYCLIC COMPOUNDS CCNI, IL2, IL4I1 KDM4E 3487/4885F13A1 1472/4885SMN1; SMN2 4280/4885
US-10927123-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ADRB3, ADRB1, ADRB2 KDM4E 4669/4885F13A1 1751/4885SMN1; SMN2 4018/4885
US-10662200-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ADRB3, ADRB1, ADRB2 KDM4E 4669/4885F13A1 1751/4885SMN1; SMN2 4018/4885
US-20110190489-A1 Novel Tricyclic Compounds CCNI, IL2, IL4I1 KDM4E 3487/4885F13A1 1472/4885SMN1; SMN2 4280/4885
US-20200270264-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF DISORDERS RELATED THERETO ADRB3, ADRB1, ADRB2 KDM4E 4669/4885F13A1 1751/4885SMN1; SMN2 4018/4885
US-11560386-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of disorders related thereto ADRB3, ADRB1, ADRB2 KDM4E 4669/4885F13A1 1751/4885SMN1; SMN2 4018/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.