SCHEMBL6621950

SCHEMBL6621950

Cc1cccc(CNC(=O)n2nc(-c3cc(NC(=O)c4cc5ccccc5s4)ccc3O)cc2C2CCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP1 Q9P0U3 3/20 0.43
▸ SENP5 Q96HI0 2/20 0.43
▸ SENP2 Q9HC62 2/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.39
▸ TMIGD3 P0DMS9 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ F10 P00742 1/20 0.37
▸ PIN1 Q13526 1/20 0.37
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ SIRT3 Q9NTG7 1/20 0.37
▸ APP P05067 1/20 0.36
▸ OPRM1 P35372 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PDK1 Q15118 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
SCHEMBL6614975 0.93 SENP1 (0.45) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6602651 0.90 SENP1 (0.46) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6620064 0.89 SENP1 (0.40) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6613706 0.89 HDAC2 (0.43) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6617853 0.87 HTR3A (0.43) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6619698 0.87 SENP1 (0.46) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6620034 0.86 TMIGD3 (0.38) SENP1SENP5SENP2PTGDR2TMIGD3
SCHEMBL6615270 0.86 CRACR2A (0.44) SENP1SENP5SENP2MEN1KMT2A
SCHEMBL6616425 0.85 NAMPT (0.40) MEN1KMT2A
SCHEMBL6605920 0.85 TMIGD3 (0.44) SENP1SENP5SENP2PTGDR2TMIGD3

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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