SCHEMBL6618415

SCHEMBL6618415

CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3cc(C4CCC4)n(C(=O)NCc4ccccc4)n3)c(O)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ PPARA Q07869 4/20 0.42
▸ PPARG P37231 2/20 0.42
▸ NR1H4 Q96RI1 5/20 0.41
▸ KCNK9 Q9NPC2 1/20 0.41
▸ NAMPT P43490 1/20 0.41
▸ ACKR3 P25106 2/20 0.39
▸ EGFR P00533 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ PPARD Q03181 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ TRPV1 Q8NER1 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
SCHEMBL6650968 0.90 RAB9A (0.42) MEN1KMT2ALMNARAB9APPARA
SCHEMBL6616573 0.89 NR1H4 (0.41) MEN1KMT2ALMNAPPARAPPARG
SCHEMBL6616880 0.89 MEN1 (0.43) MEN1KMT2ARAB9ANR1H4KCNK9
SCHEMBL6623315 0.89 KCNK3 (0.43) MEN1KMT2ARAB9APPARAPPARG
SCHEMBL6615882 0.89 NR1H4 (0.41) MEN1KMT2APPARAPPARGNR1H4
SCHEMBL6614876 0.88 MEN1 (0.43) MEN1KMT2ARAB9APPARAPPARG
SCHEMBL6608110 0.88 CRACR2A (0.44) LMNANAMPTACKR3
SCHEMBL6614537 0.88 ACKR3 (0.41) MEN1KMT2ALMNARAB9APPARA
SCHEMBL6620772 0.88 MEN1 (0.40) MEN1KMT2ARAB9ANR1H4KCNK9
SCHEMBL6608341 0.87 POLB (0.44) MEN1KMT2ARAB9ANAMPTACKR3

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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