SCHEMBL6615311

SCHEMBL6615311

COc1ccccc1C(=O)Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccccc3Cl)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM5 P08912 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ PNLIP P16233 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ KCNMA1 Q12791 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ ROCK2 O75116 1/20 0.40
▸ ROCK1 Q13464 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ PPARG P37231 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL6618884 0.92 POLB (0.42) KDM4EKCNMA1THRBMAPTMEN1
SCHEMBL6615915 0.90 PAX8 (0.49) CHRM5CHRM1CHRM3PNLIPKDM4E
SCHEMBL6615384 0.89 TP53 (0.45) KDM4EMAPTMEN1KMT2ANPC1
SCHEMBL6617068 0.88 PKM (0.38) CHRM5CHRM1CHRM3KDM4EMAPT
SCHEMBL6615822 0.88 KCNMA1 (0.41) KDM4EKCNMA1MAPTMEN1KMT2A
SCHEMBL6619198 0.87 CRACR2A (0.44) CHRM1PNLIPKCNMA1MAPTMEN1
SCHEMBL6617644 0.87 ACKR3 (0.40) USP2THRBMAPTTP53ACKR3
SCHEMBL6618271 0.87 MAPT (0.41) KDM4EMAPTMEN1KMT2ATP53
SCHEMBL6603129 0.87 TP53 (0.41) CHRM5CHRM1CHRM3ROCK2MAPT
SCHEMBL6619099 0.86 KCNK3 (0.43) KDM4EKCNMA1MAPTMEN1KMT2A

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
Send feedback