SCHEMBL16685617

SCHEMBL16685617

Cc1cc(C)nc(N(C)S(=O)(=O)c2ccc(NC(=O)NC(=O)c3cccc(Cl)c3Cl)cc2)n1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PCTP Q9UKL6 10/20 0.75
STARD10 Q9Y365 5/20 0.75
STARD7 Q9NQZ5 1/20 0.52
GRM4 Q14833 2/20 0.44
LMNA P02545 1/20 0.43
GPR27 Q9NS67 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 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
SCHEMBL1235186 0.85 PCTP (1.00) PCTPSTARD10STARD7LMNAGPR27
SCHEMBL1235180 0.83 PCTP (1.00) PCTPSTARD10STARD7LMNA
SCHEMBL1233511 0.75 PCTP (1.00) PCTPSTARD10STARD7LMNA
SCHEMBL17280988 0.72 PCTP (0.75) PCTPSTARD10STARD7LMNAGPR27
SCHEMBL9349980 0.71 CYP2C19 (0.68) PCTPSTARD10GRM4LMNAALDH1A1
SCHEMBL1235824 0.70 PCTP (0.72) PCTPSTARD10STARD7LMNAGPR27
SCHEMBL13470344 0.69 PCTP (0.60) PCTPSTARD10STARD7LMNAALDH1A1
SCHEMBL1233504 0.68 PCTP (1.00) PCTPSTARD10STARD7LMNAGPR27
SCHEMBL29556377 0.67 PCTP (0.58) PCTPSTARD10LMNAGPR27ALDH1A1
SCHEMBL28347229 0.67 PCTP (0.58) PCTPSTARD10LMNAGPR27ALDH1A1

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
WO-2015065876-A1 METHODS OF PREVENTION OR TREATMENT FOR PATHOLOGIC THROMBOSIS OR INFLAMMATION THOMAS JEFFERSON UNIVERSITY (US) 2015-05-07 WO disclosed