SCHEMBL7571863

SCHEMBL7571863

CS(=O)(=O)OCC#Cc1ccc(Br)s1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.31
HTT P42858 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
GALR3 O60755 1/20 0.31
RAB9A P51151 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL7573562 0.84 KMT2A (0.32)
SCHEMBL7581864 0.83
SCHEMBL7573401 0.83 PTGDR2 (0.36) HTTSMN1; SMN2TSHR
SCHEMBL7575152 0.74 CHRM2 (0.39)
SCHEMBL7574068 0.70
SCHEMBL7575173 0.70
SCHEMBL7580960 0.70 CYP2C19 (0.39)
SCHEMBL3452817 0.69 CA12 (0.51) HTTRAB9A
SCHEMBL25238842 0.68 RXFP1 (0.38) LMNASMN1; SMN2
SCHEMBL499731 0.67 USP2 (0.48) LMNATSHR

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
EP-0810199-B1 Method for producing propargylamine compounds SUMITOMO CHEMICAL CO (JP) 2002-09-25 EP disclosed
US-5756769-A Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1998-05-26 US disclosed
EP-0810199-A1 Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-03 EP disclosed