SCHEMBL6617432

SCHEMBL6617432

CCn1nc(-c2cc(NC(C)=O)ccc2O)cc1C1CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.46
▸ KDM4D Q6B0I6 1/20 0.46
▸ KDM4C Q9H3R0 1/20 0.46
▸ KDM5B Q9UGL1 1/20 0.46
▸ KDM3A Q9Y4C1 1/20 0.46
▸ CHRNE Q04844 3/20 0.43
▸ MAPT P10636 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ POLB P06746 1/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MAOA P21397 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ DDB1 Q16531 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
SCHEMBL6618205 0.96 KDM4E (0.45) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6616676 0.96 KDM5A (0.44) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6614347 0.87 KDM5A (0.43) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6616287 0.87 KDM5A (0.43) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6616753 0.87 KDM5A (0.43) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6615310 0.83 KDM5A (0.41) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6617972 0.83 ACHE (0.44) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6615720 0.83 ACHE (0.44) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6615112 0.82 ALDH1A1 (0.43) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6617931 0.80 KDM4E (0.39) CHRNEMAPTRAB9AKDM4EMEN1

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-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP claimed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO claimed
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