SCHEMBL6617620

SCHEMBL6617620

O=C(Nc1ccc(-c2cc(C3CC3)n(C(=O)NCc3ccccc3F)n2)c(O)c1)c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.42
▸ POLB P06746 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GRM4 Q14833 1/20 0.39
▸ CRACR2A Q9BSW2 4/20 0.39
▸ PKM P14618 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 0.38
▸ DRD1 P21728 1/20 0.37
▸ NR2E3 Q9Y5X4 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
SCHEMBL6620569 0.97 CNR1 (0.41) CNR1POLBKDM4EALDH1A1KMT2A
SCHEMBL6603129 0.93 TP53 (0.41) CNR1MAPTTP53SMN1; SMN2CRACR2A
SCHEMBL6605138 0.91 MAPT (0.42) CNR1POLBALDH1A1KMT2AMAPT
SCHEMBL6617337 0.90 CNR1 (0.39) CNR1KDM4EALDH1A1MAPTTP53
SCHEMBL6618535 0.89 CNR1 (0.41) CNR1POLBKDM4ESMN1; SMN2CRACR2A
SCHEMBL6615258 0.89 CNR1 (0.41) CNR1POLBKDM4ESMN1; SMN2CRACR2A
SCHEMBL6618658 0.89 PPARG (0.44) CNR1ALDH1A1KMT2AMAPTPKM
SCHEMBL6617490 0.88 PPARG (0.41) CNR1ALDH1A1MAPTCRACR2APKM
SCHEMBL6614980 0.87 CNR1 (0.42) CNR1KMT2AMAPTPKMKCNJ6
SCHEMBL6683281 0.86 MAPT (0.40) CNR1ALDH1A1MAPTCRACR2APKM

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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