SCHEMBL10692684

SCHEMBL10692684

COc1cc(Cl)ccc1-c1nc2c(=O)[nH]ncc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 1/20 0.46
AMY1A P0DUB6 8/20 0.46
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
PDE5A O76074 2/20 0.39
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
DHODH Q02127 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
PDE2A O00408 1/20 0.38
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37

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
SCHEMBL10688606 0.86 PDE7A (0.48) TNKSTNKS2PDE5APDE3BPDE3A
SCHEMBL10693845 0.86 GAA (0.43) PDE5APDE3BPDE3ADHODHHSD17B10
SCHEMBL10691722 0.84 MEN1 (0.38) AMY1APDE5APDE3BPDE3ADHODH
SCHEMBL10688582 0.84 PDE5A (0.38) AMY1APDE5APDE3BPDE3ADHODH
SCHEMBL10686161 0.83 CDK4 (0.42) AMY1APDE5APDE3BPDE3ADHODH
SCHEMBL10690944 0.83 EGLN2 (0.39) PDE5APDE3BPDE3ADHODHPDE2A
SCHEMBL10869682 0.82 KDM4E (0.43) AMY1ATNKSTNKS2PARP2PDE5A
SCHEMBL10691563 0.82 CA2 (0.42) PDE5APDE3BPDE3ADHODHPDE2A
SCHEMBL10686472 0.82 PDE5A (0.37) AMY1APDE5APDE3BPDE3ADHODH
SCHEMBL10685364 0.82 MKNK1 (0.46) DHODH

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 1 patent. 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