SCHEMBL2280533

SCHEMBL2280533

NCC1CCN(CCF)CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.56
CXCR4 P61073 1/20 0.42
PRMT3 O60678 1/20 0.39
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT1 Q99873 1/20 0.39
PRMT8 Q9NR22 1/20 0.39
ALOX15 P16050 1/20 0.36
SIGMAR1 Q99720 2/20 0.35
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
AKT2 P31751 2/20 0.33
GSK3B P49841 1/20 0.33
CCR3 P51677 1/20 0.32

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
SCHEMBL13569909 0.83 NCF1 (0.58) NCF1CXCR4PRMT3CARM1PRMT6
SCHEMBL22732993 0.82 PRMT3 (0.41) NCF1PRMT3CARM1PRMT6PRMT1
SCHEMBL1540650 0.79 NCF1 (0.60) NCF1CXCR4PRMT3CARM1PRMT6
SCHEMBL9343697 0.79 NCF1 (0.54) NCF1CXCR4PRMT3CARM1PRMT6
SCHEMBL103579 0.79 NCF1 (0.54) NCF1CXCR4PRMT3CARM1PRMT6
SCHEMBL8435896 0.79 NCF1 (0.38) NCF1PRMT3CARM1PRMT6PRMT1
SCHEMBL7137670 0.79 NCF1 (0.48) NCF1CXCR4PRMT3CARM1PRMT6
SCHEMBL2803853 0.78 GNAI3 (0.50) NCF1PRMT3CARM1PRMT6PRMT1
SCHEMBL14890554 0.77 NCF1 (0.56) NCF1CXCR4PRMT3CARM1PRMT6
Hydrochloric Acid SCHEMBL2293794 0.76 GNAI3 (0.53) PRMT3CARM1PRMT6PRMT1PRMT8

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105873920-B As 5-HT4The indazole compound of receptor stimulating agent 苏文生命科学有限公司 2018-06-08 CN disclosed
US-9951045-B2 Indazole compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-04-24 US disclosed
US-9951045-B2 Indazole compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-04-24 US disclosed
US-9951045-B2 Indazole compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-04-24 US disclosed
EP-3099675-B1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2018-02-14 EP disclosed
EP-3099675-B1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2018-02-14 EP disclosed
EP-3099675-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS Suven Life Sciences Limited (IN) 2016-12-07 EP disclosed
US-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-10-27 US disclosed
US-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-10-27 US disclosed
US-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-10-27 US disclosed
CN-105873920-A Indazole compounds as 5-HT4 receptor agonists 苏文生命科学有限公司 2016-08-17 CN disclosed
WO-2015092804-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2015-06-25 WO disclosed
WO-2015092804-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2015-06-25 WO disclosed
EP-2536716-B1 AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-05-21 EP disclosed
US-8426604-B2 Aminothiazolones as estrogen related receptor-alpha modulators JANSSEN PHARMACEUTICA NV (BE) 2013-04-23 US disclosed
EP-2536716-A1 AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS Janssen Pharmaceutica, N.V. (BE) 2012-12-26 EP disclosed
WO-2011103130-A1 AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-08-25 WO disclosed
US-20110200586-A1 AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-08-18 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 (2 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-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS HTR4, HTR5A, HTR1A NCF1 4170/4885CXCR4 705/4885PRMT3 946/4885
US-20110200586-A1 AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS ESR2, ESRRA, ESRRG NCF1 3889/4885CXCR4 1544/4885PRMT3 1611/4885

“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.