SCHEMBL15907960

SCHEMBL15907960

C=C(C)C(=O)SCCSCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42
CYP2C9 P11712 1/20 0.42
BLM P54132 1/20 0.42
CYP2D6 P10635 2/20 0.42
HIF1A Q16665 1/20 0.42
BHMT Q93088 1/20 0.39
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
MVD P53602 1/20 0.33
CYP2C19 P33261 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
TRPA1 O75762 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
SCHEMBL160486 0.85 TSHR (0.36) HSD17B10TSHRCYP2C19KMT2ALMNA
SCHEMBL2208055 0.85 TSHR (0.36) HSD17B10TSHRCYP2C19KMT2ALMNA
SCHEMBL997337 0.85 TSHR (0.36) HSD17B10TSHRCYP2C19KMT2ALMNA
SCHEMBL10312483 0.83 CYP2C19 (0.42) MAPTHSD17B10GMNNTP53POLB
SCHEMBL714832 0.82 TDP1 (0.38) POLBBLMTSHRCYP2C19TDP1
SCHEMBL1804131 0.81 TDP1 (0.31) TDP1
SCHEMBL14254732 0.79 TSHR (0.39) TSHR
SCHEMBL8985546 0.79 CES2 (0.32) TSHRCES2
SCHEMBL8985594 0.78 CES2 (0.31) TSHRCES2
SCHEMBL18139594 0.78 TDP1 (0.42) MAPTTSHRTDP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9201168-B2 Polymerizable inorganic-particle dispersant, inorganic-organic composite particles containing said polymerizable inorganic-particle dispersant, and inorganic-organic resin composite material NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2015-12-01 US disclosed
US-9201168-B2 Polymerizable inorganic-particle dispersant, inorganic-organic composite particles containing said polymerizable inorganic-particle dispersant, and inorganic-organic resin composite material NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2015-12-01 US disclosed
EP-2762225-A1 POLYMERIZABLE INORGANIC PARTICLE-DISPERSING AGENT, INORGANIC/ORGANIC COMPOSITE PARTICLES CONTAINING SAID POLYMERIZABLE INORGANIC PARTICLE-DISPERSING AGENT, AND INORGANIC/ORGANIC RESIN COMPOSITE Nippon Kasei Chemical Company Limited (JP) 2014-08-06 EP disclosed
US-20140213725-A1 POLYMERIZABLE INORGANIC-PARTICLE DISPERSANT, INORGANIC-ORGANIC COMPOSITE PARTICLES CONTAINING SAID POLYMERIZABLE INORGANIC-PARTICLE DISPERSANT, AND INORGANIC-ORGANIC RESIN COMPOSITE MATERIAL NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2014-07-31 US disclosed
US-20140213725-A1 POLYMERIZABLE INORGANIC-PARTICLE DISPERSANT, INORGANIC-ORGANIC COMPOSITE PARTICLES CONTAINING SAID POLYMERIZABLE INORGANIC-PARTICLE DISPERSANT, AND INORGANIC-ORGANIC RESIN COMPOSITE MATERIAL NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2014-07-31 US disclosed