SCHEMBL14889196

SCHEMBL14889196

COCCN(CCC1CNCCO1)C(=O)Cc1c(-c2ccc(C)cc2)nc2cc(C)ccn12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ALB P02768 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ GABRA1 P14867 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ GABRB1 P18505 1/20 0.39
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ GABRA2 P47869 1/20 0.39
▸ GABRB2 P47870 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
Hydrochloric Acid SCHEMBL14889270 0.99 KDM4E (0.38) KDM4ELMNAALBCYP3A4CHRM1
SCHEMBL14889213 0.90 GABRB2 (0.52) KDM4ELMNAALBCYP3A4CHRM1
Hydrochloric Acid SCHEMBL14889113 0.89 GABRB2 (0.51) KDM4ELMNAALBCYP3A4CHRM1
SCHEMBL14889195 0.83 GABRA1 (0.38) KDM4ELMNAALBCYP3A4CHRM1
Hydrochloric Acid SCHEMBL14889269 0.83 GABRA1 (0.37) KDM4ELMNAALBCYP3A4CHRM1
SCHEMBL14899705 0.79 KDM4E (0.52) KDM4ELMNAALBCYP3A4CHRM1
Hydrochloric Acid SCHEMBL25412592 0.79 KDM4E (0.52) KDM4ELMNAALBCYP3A4CHRM1
SCHEMBL14889211 0.74 TSPO (0.45) KDM4ELMNAALBCYP3A4CHRM1
SCHEMBL30589252 0.74 TSPO (0.45) KDM4ELMNAALBCYP3A4CHRM1
Hydrochloric Acid SCHEMBL14889118 0.73 TSPO (0.44) KDM4ELMNAALBCYP3A4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2586780-B1 2-ARYL IMIDAZO[1,2-A]PYRIDINE-3-ACETAMIDE DERIVATIVES, PREPARATION METHODS AND USE THEREOF INST PHARMACOLOGY & TOXICOLOGY ACAD MILITARY MEDICAL SCIENCES PLA CHINA (CN) 2017-03-22 — — EP disclosed
EP-2586780-A1 2-ARYL IMIDAZO[1,2-A]PYRIDINE-3-ACETAMIDE DERIVATIVES, PREPARATION METHODS AND USE THEREOF Institute Of Pharmacology And Toxicology Academy Of Military Medical Sciences P.L.A. China (CN) 2013-05-01 — — EP disclosed
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