SCHEMBL8985291

SCHEMBL8985291

CS(=O)(=O)c1ccc(-c2c(C(N)=O)csc2-c2ccc(NCC=O)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.37
GHSR Q92847 10/20 0.37
MC4R P32245 1/20 0.37
CSF1R P07333 2/20 0.37
IKBKB O14920 1/20 0.35
CHUK O15111 1/20 0.35
PTGS2 P35354 1/20 0.34

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
SCHEMBL8985293 0.79 MC4R (0.37) MC4RIKBKBCHUKPTGS2
SCHEMBL8985469 0.76 AURKA (0.47) TGM2IKBKBCHUKPTGS2
SCHEMBL8985260 0.69 PTGS2 (0.65) PTGS2
SCHEMBL9203678 0.67 EPHX2 (0.48) PTGS2
SCHEMBL8985406 0.67 MAPK14 (0.51) GHSRPTGS2
SCHEMBL8985189 0.67 PTGS2 (0.49) PTGS2
SCHEMBL14624916 0.64 CA12 (0.49) TGM2
SCHEMBL7759448 0.62 TGM2 (0.61) TGM2PTGS2
SCHEMBL12463872 0.62 CA1 (0.70)
SCHEMBL9206865 0.62 EPHX2 (0.52) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571810-A ANTIINFLAMMATORY AGENTS, ANALGESICS, COLLAGEN DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-05 US disclosed
EP-0593761-A1 NEW THIOPHENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed
WO-1991019708-A1 NEW THIOPHENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-26 WO disclosed