SCHEMBL6616193

SCHEMBL6616193

C=CCn1nc(-c2ccc(NC(=O)C(C)C)cc2O)cc1C1CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ AAK1 Q2M2I8 2/20 0.39
▸ KDM4E B2RXH2 6/20 0.37
▸ ALDH1A1 P00352 6/20 0.37
▸ GLA P06280 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ CASP3 P42574 2/20 0.36
▸ SENP7 Q9BQF6 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TYR P14679 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35

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
SCHEMBL6618542 0.94 KMT2A (0.37) KMT2AAAK1KDM4EALDH1A1GLA
SCHEMBL6617913 0.91 KMT2A (0.36) KMT2AAAK1KDM4EALDH1A1GLA
SCHEMBL6620081 0.86 KMT2A (0.43) KMT2AAAK1KDM4EALDH1A1GLA
SCHEMBL6629335 0.83 ALDH1A1 (0.44) KMT2AAAK1KDM4EALDH1A1HSD17B10
SCHEMBL6614347 0.83 KDM5A (0.43) KMT2AKDM4EALDH1A1HSD17B10HPGD
SCHEMBL6620548 0.81 ALDH1A1 (0.40) KMT2AAAK1KDM4EALDH1A1HSD17B10
SCHEMBL6617931 0.80 KDM4E (0.39) KMT2AKDM4EALDH1A1GLARECQL
SCHEMBL6615699 0.79 KMT2A (0.37) KMT2AAAK1KDM4EALDH1A1GLA
SCHEMBL6615310 0.79 KDM5A (0.41) KMT2AKDM4EALDH1A1HSD17B10HPGD
SCHEMBL6615707 0.78 KMT2A (0.42) KMT2AAAK1KDM4EALDH1A1GLA

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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