SCHEMBL6621197

SCHEMBL6621197

CCC(C)NC(=O)n1nc(-c2cc(NC(C)=O)ccc2O)cc1C1CCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.41
▸ KDM4D Q6B0I6 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ KDM5B Q9UGL1 1/20 0.41
▸ KDM3A Q9Y4C1 1/20 0.41
▸ CHRNE Q04844 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ NAMPT P43490 5/20 0.35
▸ HTT P42858 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL6615986 0.91 KMT2A (0.40) LMNAMEN1KMT2ANAMPTHTT
SCHEMBL6616688 0.90 AAK1 (0.37) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6617588 0.90 KDM5A (0.42) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6618662 0.88 KMT2A (0.38) LMNAKDM4EMEN1MAPTRAB9A
SCHEMBL6619183 0.88 NAMPT (0.40) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6619106 0.87 CRACR2A (0.45) KDM4CMEN1MAPTRAB9AKMT2A
SCHEMBL6616599 0.85 KMT2A (0.43) LMNAMEN1KMT2ANAMPTCYP2D6
SCHEMBL6619635 0.85 KDM5A (0.41) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL6617536 0.85 AAK1 (0.40) LMNAKDM4EMEN1MAPTRAB9A
SCHEMBL6618939 0.84 KMT2A (0.43) LMNAKDM4EMEN1MAPTRAB9A

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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