SCHEMBL6617337

SCHEMBL6617337

O=C(Nc1ccc(-c2cc(C3CCC3)n(C(=O)NCc3ccccc3Cl)n2)c(O)c1)c1ccccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PTGES O14684 1/20 0.39
▸ ACKR3 P25106 1/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ NR2E3 Q9Y5X4 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CASP3 P42574 2/20 0.38
▸ CHRM5 P08912 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
SCHEMBL6603129 0.97 TP53 (0.41) CNR1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL6620569 0.94 CNR1 (0.41) CNR1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL6617068 0.94 PKM (0.38) MAPTLMNASMN1; SMN2RAB9APKM
SCHEMBL6603314 0.92 PPARG (0.40) CNR1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL6617620 0.90 CNR1 (0.42) CNR1MAPTSMN1; SMN2PKMROCK2
SCHEMBL6618955 0.90 JAK2 (0.40) CNR1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL6617735 0.90 PKM (0.42) MAPTLMNASMN1; SMN2RAB9APKM
SCHEMBL6616448 0.90 EPHX2 (0.40) CNR1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL6619198 0.89 CRACR2A (0.44) MAPTSMN1; SMN2PTGESGAATP53
SCHEMBL6621094 0.89 PPARG (0.43) CNR1MAPTLMNASMN1; SMN2RAB9A

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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