SCHEMBL1648006

SCHEMBL1648006

CCSSc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
CYP3A4 P08684 4/20 0.34
MAPK1 P28482 4/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TSHR P16473 3/20 0.33
RECQL P46063 3/20 0.33
HSD17B10 Q99714 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
TP53 P04637 2/20 0.33
FBP1 P09467 1/20 0.31
MEN1 O00255 4/20 0.31
KMT2A Q03164 4/20 0.31
HPGD P15428 3/20 0.31
ALOX15 P16050 3/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
NR1I2 O75469 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 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
SCHEMBL1647439 0.83 NMT1 (0.32)
SCHEMBL1645523 0.77 CYP3A4 (0.38) ALDH1A1CYP3A4MAPK1CYP1A2CYP2C19
SCHEMBL253970 0.77 ALDH1A1 (0.50) ALDH1A1CYP3A4MAPK1CYP1A2CYP2C9
SCHEMBL1646155 0.74 TSHR (0.38) CYP3A4TSHRTP53FBP1
SCHEMBL1648142 0.74 FBP1 (0.45) ALDH1A1CYP3A4MAPK1CYP1A2CYP2C9
SCHEMBL1645138 0.70 FBP1 (0.31) FBP1TXN
SCHEMBL1647130 0.70
SCHEMBL20196059 0.70 GRIN2D (0.38) ALDH1A1CYP3A4MAPK1CYP1A2CYP2C9
SCHEMBL1646060 0.69 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPK1TSHRRECQL
SCHEMBL25967301 0.69 ALDH1A1 (0.41) ALDH1A1CYP3A4MAPK1TSHRRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426526-B2 Solid golf ball SRI SPORTS LIMITED (JP) 2013-04-23 US disclosed
US-20110086727-A1 SOLID GOLF BALL SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2011-04-14 US disclosed