SCHEMBL1123020

SCHEMBL1123020

C=CS(=O)(=O)Nc1ccc2c(ccn2-c2c(OC)cc(OC)cc2OC)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.41
SRC P12931 2/20 0.39
MAPK1 P28482 1/20 0.39
BRPF1 P55201 5/20 0.39
BRD1 O95696 2/20 0.39
LRRK2 Q5S007 1/20 0.37
TRIM24 O15164 2/20 0.36
PKM P14618 1/20 0.36
TEAD4 Q15561 1/20 0.36
GSTO1 P78417 1/20 0.36
TGM2 P21980 1/20 0.35
BRD9 Q9H8M2 1/20 0.35
BRD7 Q9NPI1 1/20 0.35
BRPF3 Q9ULD4 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
SCHEMBL1122795 0.80 BRD4 (0.46) BRD4SRCMAPK1BRPF1BRD1
SCHEMBL1122752 0.72 SRC (0.37) BRD4SRCLRRK2
SCHEMBL9179590 0.69 TGM2 (0.59) BRD4SRCMAPK1TEAD4TGM2
SCHEMBL18437810 0.68 BRD4 (0.44) BRD4SRCLRRK2
SCHEMBL18437814 0.68 BRD4 (0.44) BRD4SRCLRRK2
SCHEMBL7259187 0.66 EGFR (0.36)
SCHEMBL1122446 0.61 ALDH1A1 (0.63) MAPK1
SCHEMBL20782676 0.61 PDE10A (0.43) SRCPKM
SCHEMBL18437729 0.61 PTGS2 (0.47)
SCHEMBL6343382 0.60 PKM (0.61) BRD4BRPF1BRD1PKMBRD9

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-1379508-B9 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF UNIV TEMPLE (US) 2011-02-09 EP disclosed
EP-1379508-B1 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF UNIV TEMPLE (US) 2010-09-01 EP disclosed