SCHEMBL10690686

SCHEMBL10690686

COc1cc(C#N)ccc1-c1nc2[nH]c(=O)ncc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
PDE2A O00408 1/20 0.39
SCN9A Q15858 2/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
EGLN1 Q9GZT9 6/20 0.39
CCNT1 O60563 1/20 0.39
CDK9 P50750 1/20 0.39
PLK1 P53350 1/20 0.38
IDH1 O75874 1/20 0.38
PDE5A O76074 2/20 0.38
PDE3B Q13370 2/20 0.38
PDE3A Q14432 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL10691571 0.82 PDE2A (0.41) PDE2APDE5APDE3BPDE3AKDM4E
SCHEMBL10689310 0.79 MKNK1 (0.47) LRRK2
SCHEMBL10692555 0.79 CA2 (0.43) PDE2ACCNT1CDK9PDE5APDE3B
SCHEMBL10690895 0.78 TAS2R14 (0.40) PDE2ASCN9APDE5APDE3BPDE3A
SCHEMBL10686293 0.77 GRIN2D (0.42) PDE2AGRIN1GRIN2BPDE5APDE3B
SCHEMBL10692548 0.77 MAPT (0.46) PDE2APDE5APDE3BPDE3AKDM4E
SCHEMBL10690944 0.76 EGLN2 (0.39) EGLN2CYP11B1CYP11B2PDE2AIDH1
SCHEMBL10673698 0.76 PDE5A (0.48) EGLN2CYP11B1CYP11B2PDE2APDE5A
SCHEMBL10687648 0.76 ADORA2B (0.44) EGLN2CYP11B1CYP11B2SCN9ACCNT1
SCHEMBL10745392 0.76 PDE2A (0.47) EGLN2CYP11B1CYP11B2PDE2ASCN9A

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
US-4722929-A Novel 2-phenyl-imidazoles and pharmaceutical compositions containing same DR. KARL THOMAE GMBH (DE) 1988-02-02 US disclosed
EP-0149200-A1 Novel 2-pnenyl-imidazoles, their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1985-07-24 EP disclosed