SCHEMBL9740362

SCHEMBL9740362

Cc1ccc(C)c(SC[N+](=O)[O-])c1C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 3/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP3A4 P08684 2/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL9711302 0.82 TDP1 (0.47) TSHRSMN1; SMN2TDP1ALDH1A1HSD17B10
SCHEMBL7229176 0.72 MAPT (0.38) TSHRSMN1; SMN2TDP1ALDH1A1CYP3A4
SCHEMBL9336377 0.67
SCHEMBL9353183 0.67 PDE7A (0.36) SMN1; SMN2TDP1ALDH1A1RECQL
SCHEMBL7226114 0.65 SMN1; SMN2 (0.41) SMN1; SMN2TDP1ALDH1A1CYP3A4HSD17B10
SCHEMBL9711236 0.65 TDP1 (0.40) TSHRSMN1; SMN2TDP1ALDH1A1HSD17B10
SCHEMBL9711273 0.65 KMT2A (0.37) TSHRSMN1; SMN2TDP1ALDH1A1RECQL
SCHEMBL9350811 0.64 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9740135 0.64 TSHR (0.45) TSHRSMN1; SMN2TDP1ALDH1A1CYP3A4
SCHEMBL9194581 0.64 TDP2 (0.40) TSHR

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
US-5153227-A Treatment of diabetes and galactosemia complications IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-10-06 US disclosed