SCHEMBL6615391

SCHEMBL6615391

O=C(Nc1ccc(-c2cc(C3CC3)n(C(=O)NCc3ccccc3Cl)n2)c(O)c1)c1ccno1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ACKR3 P25106 2/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.38
▸ CNR1 P21554 2/20 0.37
▸ KCNJ6 P48051 1/20 0.37
▸ KCNJ5 P48544 1/20 0.37
▸ KCNJ3 P48549 1/20 0.37
▸ TP53 P04637 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ANO1 Q5XXA6 1/20 0.36
▸ ROCK2 O75116 2/20 0.35
▸ SLC5A2 P31639 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ POLB P06746 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
SCHEMBL6618817 0.91 MAPK14 (0.43) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6616464 0.90 KDM4C (0.42) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6603129 0.87 TP53 (0.41) ACKR3CNR1TP53GAALMNA
SCHEMBL6615628 0.86 KDM4C (0.44) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6617873 0.85 MAPK14 (0.40) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6614689 0.85 MAPK14 (0.44) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6615451 0.85 MAPK14 (0.43) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6615668 0.85 KDM4C (0.49) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6614939 0.85 KDM4C (0.41) KMT2AMEN1ACKR3MAPK14KDM4C
SCHEMBL6615529 0.84 MAPK14 (0.41) KMT2AMEN1ACKR3MAPK14KDM4C

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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