SCHEMBL5046977

SCHEMBL5046977

O=C(O)Oc1cc2sc(OC(=O)O)cc2s1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.33

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
SCHEMBL5040190 0.88 PKM (0.41)
SCHEMBL5044287 0.82 GPR35 (0.55) GPR35
SCHEMBL2761209 0.79 BCL2L1 (0.56)
SCHEMBL16712270 0.75 CLK1 (0.38)
SCHEMBL5163126 0.75 LMNA (0.50)
SCHEMBL5233617 0.75 CYP2A6 (0.53)
SCHEMBL5202024 0.75 RAB9A (0.39)
SCHEMBL5234254 0.75 KMT2A (0.39)
SCHEMBL5230598 0.75 STING1 (0.54)
SCHEMBL5238184 0.75 KMT2A (0.41)

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-1715840-B1 KERATIN DYEING COMPOSITIONS CONTAINING BICYCLIC FUSED 5-5 HETEROAROMATIC DYES PROCTER & GAMBLE (US) 2008-12-03 EP claimed