SCHEMBL6616371

SCHEMBL6616371

Cc1ccc(C(=O)Nc2ccc(-c3cc(C4CCCC4)n(C(=O)NCc4ccccc4Cl)n3)c(O)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 3/20 0.43
▸ P2RY14 Q15391 1/20 0.42
▸ MAPT P10636 4/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.39
▸ TP53 P04637 4/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ PLA2G1B P04054 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ KCNJ6 P48051 1/20 0.38
▸ KCNJ5 P48544 1/20 0.38
▸ KCNJ3 P48549 1/20 0.38
▸ ROCK2 O75116 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ CNR1 P21554 1/20 0.37

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
SCHEMBL6660284 0.94 ACKR3 (0.42) ACKR3P2RY14MAPTSMN1; SMN2LMNA
SCHEMBL6619665 0.92 P2RY14 (0.41) P2RY14MAPTTP53POLBKCNJ6
SCHEMBL6614591 0.91 P2RY14 (0.42) P2RY14MAPTSMN1; SMN2TP53L3MBTL1
SCHEMBL6605931 0.89 ACKR3 (0.43) ACKR3MAPTSMN1; SMN2LMNATP53
SCHEMBL6618955 0.89 JAK2 (0.40) ACKR3MAPTSMN1; SMN2LMNARXFP1
SCHEMBL6613507 0.88 MAPT (0.42) P2RY14MAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL6618105 0.88 CCR2 (0.40) MAPTSMN1; SMN2LMNATP53POLB
SCHEMBL6617337 0.87 CNR1 (0.39) ACKR3MAPTSMN1; SMN2LMNATP53
SCHEMBL6606378 0.87 CNR1 (0.40) ACKR3MAPTSMN1; SMN2LMNAPKM
SCHEMBL6617708 0.87 ACKR3 (0.41) ACKR3MAPTSMN1; SMN2LMNARXFP1

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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