SCHEMBL9308282

SCHEMBL9308282

CCCc1nc(C)c(C=O)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.38
MAPK1 P28482 1/20 0.38
POLB P06746 2/20 0.36
KDM4C Q9H3R0 1/20 0.34
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.30
GPR84 Q9NQS5 1/20 0.30
PDE5A O76074 1/20 0.30
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30

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
SCHEMBL17949542 0.89 ALDH1A1 (0.41) MAPK1ALDH1A1GPR84
SCHEMBL811725 0.84 TP53 (0.41) POLBKMT2AALDH1A1
SCHEMBL4352906 0.81 GLA (0.38) GLAPOLBKDM4CKMT2AKDM4E
SCHEMBL19091935 0.81 MAPK1 (0.38) GLAMAPK1POLBKDM4CALDH1A1
SCHEMBL9029353 0.79 GLA (0.37) GLAPOLBKDM4CKMT2AKDM4E
SCHEMBL9295900 0.79 GLA (0.37) GLAPOLBKDM4CKMT2AKDM4E
SCHEMBL895 0.79 GLA (0.37) GLAPOLBKDM4CKMT2AKDM4E
SCHEMBL4638662 0.79 GLA (0.37) GLAPOLBKDM4CKMT2AKDM4E
SCHEMBL9198148 0.74 KDM4C (0.37) GLAMAPK1POLBKDM4CKMT2A
SCHEMBL11078634 0.73 GLA (0.38) GLAMAPK1POLBKDM4CKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5374646-A Treatment or prophylasix of hypertension and diseases associated with cognitive disorders GLAXO GROUP LIMITED (GB) 1994-12-20 US disclosed
WO-1992020673-A1 ANTIHYPOTENSIVE BENZOFURAN DERIVATIVES WITH N-LINKED 1H-IMIDAZOLYLMETHYL-5-CARBOXAMIDE SUBSTITUENTS GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
EP-0514216-A1 Antihypotensive benzofuran derivatives with N-linked 1H-imidazolyl-methyl-5-carboxamide substituents GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed