SCHEMBL7769640

SCHEMBL7769640

CSc1cc(=O)c2sccc2s1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.35
PKM P14618 1/20 0.31
LIG1 P18858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8915170 0.75 GPR35 (0.42) GPR35PKMLIG1ALDH1A1
SCHEMBL7775975 0.67 CYP1A2 (0.30) PKMLIG1
SCHEMBL7830917 0.66 GPR35 (0.33) GPR35ALDH1A1
SCHEMBL7774018 0.66 ALDH1A1 (0.41) PKMALDH1A1SMN1; SMN2
SCHEMBL7774088 0.66 ALDH1A1 (0.39) PKMLIG1ALDH1A1SMN1; SMN2
SCHEMBL16476054 0.64 GPR35 (0.34) GPR35
SCHEMBL7769690 0.64 TSHR (0.48) ALDH1A1SMN1; SMN2
SCHEMBL407079 0.63 GPR35 (0.46) GPR35ALDH1A1
SCHEMBL7777235 0.62 GPR35 (0.35) GPR35ALDH1A1
SCHEMBL7774397 0.62 HSD17B10 (0.36) PKMLIG1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6294527-B1 ANTIBIOTICS FOR METHACILLIN RESISTANT BACTERIA ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2001-09-25 US disclosed
EP-0949262-B1 CEPHEM COMPOUNDS ZENYAKU KOGYO KK (JP) 2001-08-22 EP disclosed
EP-1090920-A1 CEPHEM COMPOUNDS ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2001-04-11 EP disclosed
EP-0949262-A1 CEPHEM COMPOUNDS ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-10-13 EP disclosed