SCHEMBL3489530

SCHEMBL3489530

Brc1cnc(N2CCC(c3nc(COc4ccc(-n5cnnn5)cc4)cs3)CC2)nc1

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.81
KMT2A Q03164 2/20 0.37
POLB P06746 2/20 0.37
ATF4 P18848 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
BLM P54132 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL1118310 0.92 GPR119 (0.85) GPR119KMT2APOLBMEN1ALDH1A1
SCHEMBL1118196 0.91 GPR119 (0.81) GPR119KMT2APOLBMEN1ALDH1A1
SCHEMBL1118355 0.91 GPR119 (0.81) GPR119KMT2APOLBMEN1ALDH1A1
SCHEMBL3488237 0.91 GPR119 (0.81) GPR119KMT2APOLBMEN1ALDH1A1
SCHEMBL1118313 0.90 GPR119 (0.83) GPR119KMT2AMEN1ALDH1A1ALOX15
Mbx-2982 SCHEMBL1118326 0.90 GPR119 (1.00) GPR119KMT2AMEN1ALDH1A1ALOX15
Mbx-2982 SCHEMBL1662567 0.89 GPR119 (0.98) GPR119KMT2AMEN1ALDH1A1ALOX15
SCHEMBL11885634 0.89 GPR119 (0.78) GPR119
SCHEMBL3488276 0.88 GPR119 (0.88) GPR119
SCHEMBL1118202 0.88 GPR119 (0.75) GPR119KMT2APOLBMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2111107-B1 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC (US) 2013-04-24 EP claimed
US-8227495-B2 2,4-disubsituted thiazoles and pharmaceutical compositions thereof METABOLEX INC. (US) 2012-07-24 US claimed
EP-3493807-A1 OXYMETHYLENE ARYL COMPOUNDS FOR TREATING INFLAMMATORY GASTROINTESTINAL DISEASES OR GASTROINTESTINAL CONDITIONS CymaBay Therapeutics, Inc. (US) 2019-06-12 EP disclosed
US-10292983-B2 Oxymethylene aryl compounds for treating inflammatory gastrointestinal diseases or gastrointestinal conditions CYMABAY THERAPEUTICS, INC. (US) 2019-05-21 US disclosed
US-10292983-B2 Oxymethylene aryl compounds for treating inflammatory gastrointestinal diseases or gastrointestinal conditions CYMABAY THERAPEUTICS, INC. (US) 2019-05-21 US disclosed
US-9925189-B2 Heterocyclic receptor agonists for the treatment of diabetes and metabolic disorders CYMABAY THERAPEUTICS, INC. (US) 2018-03-27 US disclosed
US-9925189-B2 Heterocyclic receptor agonists for the treatment of diabetes and metabolic disorders CYMABAY THERAPEUTICS, INC. (US) 2018-03-27 US disclosed
US-9925189-B2 Heterocyclic receptor agonists for the treatment of diabetes and metabolic disorders CYMABAY THERAPEUTICS, INC. (US) 2018-03-27 US disclosed
US-20180036307-A1 OXYMETHYLENE ARYL COMPOUNDS FOR TREATING INFLAMMATORY GASTROINTESTINAL DISEASES OR GASTROINTESTINAL CONDITIONS CYMABAY THERAPEUTICS INC (US) 2018-02-08 US disclosed
WO-2018026890-A1 OXYMETHYLENE ARYL COMPOUNDS FOR TREATING INFLAMMATORY GASTROINTESTINAL DISEASES OR GASTROINTESTINAL CONDITIONS CYMABAY THERAPEUTICS (US) 2018-02-08 WO disclosed
WO-2018026890-A1 OXYMETHYLENE ARYL COMPOUNDS FOR TREATING INFLAMMATORY GASTROINTESTINAL DISEASES OR GASTROINTESTINAL CONDITIONS CYMABAY THERAPEUTICS (US) 2018-02-08 WO disclosed
US-20100087465-A1 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. 2010-04-08 US disclosed
US-7638541-B2 treatment of Type II diabetes and other diseases associated with poor glycemic control METABOLEX INC. (US) 2009-12-29 US disclosed
US-7638541-B2 treatment of Type II diabetes and other diseases associated with poor glycemic control METABOLEX INC. (US) 2009-12-29 US disclosed
US-20090270404-A1 OXYMETHYLENE ARYL COMPOUNDS AND USES THEREOF METABOLEX, INC. 2009-10-29 US disclosed
US-20090270404-A1 OXYMETHYLENE ARYL COMPOUNDS AND USES THEREOF METABOLEX, INC. 2009-10-29 US disclosed
EP-2111107-A2 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS Metabolex Inc. (US) 2009-10-28 EP disclosed
US-20090054475-A1 treatment of Type II diabetes and other diseases associated with poor glycemic control METABOLEX, INC. (US) 2009-02-26 US disclosed
US-20090054475-A1 treatment of Type II diabetes and other diseases associated with poor glycemic control METABOLEX, INC. (US) 2009-02-26 US disclosed
WO-2008083238-A2 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC. (US) 2008-07-10 WO 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 (5 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-20100087465-A1 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS GPR119, INSR, GLP1R GPR119 1/4885KMT2A 2629/4885POLB 4166/4885
US-10292983-B2 Oxymethylene aryl compounds for treating inflammatory gastrointestinal diseases or gastrointestinal conditions GPR119, GIPR, GLP1R GPR119 1/4885KMT2A 2722/4885POLB 4425/4885
US-20090270404-A1 OXYMETHYLENE ARYL COMPOUNDS AND USES THEREOF GPR119, GLP1R, DPP4 GPR119 1/4885KMT2A 1639/4885POLB 4642/4885
US-20180036307-A1 OXYMETHYLENE ARYL COMPOUNDS FOR TREATING INFLAMMATORY GASTROINTESTINAL DISEASES OR GASTROINTESTINAL CONDITIONS GPR119, GIPR, GLP1R GPR119 1/4885KMT2A 2722/4885POLB 4425/4885
US-20090054475-A1 treatment of Type II diabetes and other diseases associated with poor glycemic control SLC5A2, IAPP, GPR119 GPR119 3/4885KMT2A 2073/4885POLB 2244/4885

“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.