SCHEMBL7580427

SCHEMBL7580427

Cc1ccc(C#CCOS(C)(=O)=O)o1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 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
SCHEMBL7575448 0.83
SCHEMBL7581246 0.83
SCHEMBL7575173 0.83
SCHEMBL7574100 0.74 ALOX5 (0.35) TDP1
SCHEMBL7573166 0.70 TDP1 (0.40) TDP1
SCHEMBL3452817 0.69 CA12 (0.51)
SCHEMBL7573562 0.68 KMT2A (0.32)
SCHEMBL499731 0.67 USP2 (0.48)
SCHEMBL10591503 0.67 TDP1 (0.37) TDP1
SCHEMBL12200065 0.67 CHRM2 (0.42) TDP1

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