SCHEMBL14409138

SCHEMBL14409138

Cc1c(C(=O)c2ccc(Cl)cc2)c2ccccc2n1-c1ccc(CBr)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.58
▸ USP14 P54578 14/20 0.57
▸ ABCB1 P08183 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ HDAC6 Q9UBN7 2/20 0.44
▸ CNR2 P34972 1/20 0.43

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
SCHEMBL2983398 0.90 RORC (0.54) RORCUSP14HDAC6CNR2
SCHEMBL2978432 0.80 RORC (0.56) RORCUSP14HDAC6CNR2
SCHEMBL19298011 0.79 USP14 (0.70) RORCUSP14
SCHEMBL18235058 0.79 USP14 (0.70) RORCUSP14
SCHEMBL18235061 0.76 USP14 (0.66) RORCUSP14
SCHEMBL13740012 0.73 USP14 (1.00) USP14
SCHEMBL2984681 0.73 RORC (0.51) RORCUSP14HDAC6
SCHEMBL1744667 0.72 SRD5A2 (0.57) —
SCHEMBL2980941 0.72 SMN1; SMN2 (0.54) RORC
SCHEMBL13741172 0.72 USP14 (1.00) USP14

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1837329-A1 NOVEL HETEROARYL DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-09-26 — — EP disclosed
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