SCHEMBL10691571

SCHEMBL10691571

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
CDK4 P11802 7/20 0.40
CCNA2 P20248 7/20 0.40
CCND1 P24385 7/20 0.40
CDK2 P24941 7/20 0.40
CCND3 P30281 7/20 0.40
PDE5A O76074 3/20 0.40
PDE3B Q13370 2/20 0.40
PDE3A Q14432 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CHEK1 O14757 1/20 0.40

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
SCHEMBL10686791 0.88 MEN1 (0.40) ESR2PDE5AKMT2AKDM4EMEN1
SCHEMBL10692084 0.86 PDE5A (0.44) PDE2APDE5AKMT2AKDM4EMEN1
SCHEMBL10689310 0.84 MKNK1 (0.47)
SCHEMBL10610755 0.82 ESR1 (0.43) PDE2AESR1ESR2CDK4CCNA2
SCHEMBL10690686 0.82 EGLN2 (0.39) PDE2APDE5APDE3BPDE3AKMT2A
SCHEMBL10692555 0.81 CA2 (0.43) PDE2APDE5APDE3BPDE3AKMT2A
SCHEMBL10690895 0.81 TAS2R14 (0.40) PDE2APDE5APDE3BPDE3AKMT2A
SCHEMBL10686293 0.80 GRIN2D (0.42) PDE2APDE5APDE3BPDE3AKMT2A
SCHEMBL10692548 0.80 MAPT (0.46) PDE2ACCNA2CDK2PDE5APDE3B
SCHEMBL10685094 0.78 PDE2A (0.46) PDE2APDE5APDE3BPDE3AKMT2A

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