SCHEMBL27985115

SCHEMBL27985115

Cc1cc(C(S)S)c(N)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP1A2 P05177 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP7 P55210 1/20 0.43
HIF1A Q16665 1/20 0.43
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
GFER P55789 1/20 0.38
TERT O14746 1/20 0.37
TDP1 Q9NUW8 3/20 0.36
CASP1 P29466 1/20 0.36
UHRF1 Q96T88 1/20 0.33
ATAD2 Q6PL18 1/20 0.33
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL169738 0.78 POLB (0.53) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
SCHEMBL439013 0.73 CYP3A4 (0.80) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
SCHEMBL27984688 0.71 ALDH1A1 (0.34) ALDH1A1HSD17B10CYP1A2ALOX15CASP7
SCHEMBL25555727 0.70 POLB (0.61) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
SCHEMBL2386087 0.70 CYP3A4 (0.75) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL31703327 0.70 CYP3A4 (0.75) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
SCHEMBL29452873 0.70 CYP3A4 (0.75) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
SCHEMBL33943 0.69 CYP3A4 (0.86) CYP3A4TSHRMAPK1ALDH1A1HSD17B10
SCHEMBL11513709 0.69 CYP3A4 (0.35) CYP3A4TSHRMAPK1
SCHEMBL8579882 0.69 CYP3A4 (0.38) CYP3A4TSHRMAPK1ALDH1A1HSD17B10

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
CN-101648421-B Method of manufacturing plastic lens, gasket for molding plastic lens, casting mold for molding plastic lens, casting jig for plastic lens starting material liquid, holding member for plastic lens cas HOYA CORPORATION (JP) 2014-10-15 CN disclosed