SCHEMBL15664453

SCHEMBL15664453

Nc1cccc(CCCCCSS(=O)(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.46
MAOB P27338 2/20 0.46
CYP19A1 P11511 2/20 0.45
MGLL Q99685 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
NOS1 P29475 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
PRMT1 Q99873 1/20 0.38
GLS O94925 1/20 0.37
FAAH O00519 1/20 0.37
GRM2 Q14416 1/20 0.36
GRM3 Q14832 1/20 0.36

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
SCHEMBL15665350 1.00 MAOA (0.46) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL15665053 0.98 MAOB (0.47) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL15664821 0.94 MAOA (0.49) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL15665495 0.89 MAOA (0.53) MAOAMAOBCYP19A1ALDH1A1TSHR
SCHEMBL15664316 0.83 MAOB (0.47) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL15665189 0.83 MAOB (0.47) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL1606798 0.81 MGLL (0.51) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL1606350 0.81 MGLL (0.51) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL1607003 0.81 MGLL (0.51) MAOAMAOBCYP19A1MGLLALDH1A1
SCHEMBL15665038 0.81 MAOB (0.48) MAOAMAOBCYP19A1MGLLALDH1A1

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
US-8946325-B2 Tire member and method for manufacturing the same TOYO TIRE & RUBBER CO., LTD. (JP) 2015-02-03 US disclosed
US-20140128525-A1 TIRE MEMBER AND METHOD FOR MANUFACTURING THE SAME TOYO TIRE & RUBBER CO., LTD. (JP) 2014-05-08 US disclosed
US-20140128498-A1 TIRE MEMBER AND METHOD FOR MANUFACTURING THE SAME TOYO TIRE & RUBBER CO., LTD. (JP) 2014-05-08 US disclosed