SCHEMBL1646162

SCHEMBL1646162

Clc1cc(Cl)c(Cl)c(SSc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.56
HPGD P15428 6/20 0.41
HSD17B10 Q99714 6/20 0.41
TSHR P16473 6/20 0.41
CASP1 P29466 1/20 0.41
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 3/20 0.38
HSP90AA1 P07900 2/20 0.38
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
AHR P35869 6/20 0.35
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
USP2 O75604 1/20 0.32
EGFR P00533 1/20 0.32
LMNA P02545 1/20 0.32
ESR1 P03372 1/20 0.32
ERBB2 P04626 1/20 0.32
CYP1A2 P05177 1/20 0.32
LCK P06239 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
SCHEMBL260696 0.94 CYP3A4 (0.53) CYP3A4HPGDHSD17B10TSHRCASP1
SCHEMBL6518691 0.82 CYP3A4 (0.56) CYP3A4HPGDHSD17B10TSHRCASP1
SCHEMBL224297 0.80 MEN1 (0.31) HPGDHSD17B10TSHRALDH1A1MEN1
SCHEMBL1646060 0.78 ALDH1A1 (0.48) CYP3A4HPGDHSD17B10TSHRCASP1
SCHEMBL1646979 0.74 NMT1 (0.35) CYP3A4
Pentachlorobenzene SCHEMBL11455164 0.73 CYP3A4 (1.00) CYP3A4HPGDHSD17B10TSHRCASP1
Pentachlorobenzene SCHEMBL183144 0.73 CYP3A4 (1.00) CYP3A4HPGDHSD17B10TSHRCASP1
SCHEMBL1645523 0.72 CYP3A4 (0.38) CYP3A4HPGDHSD17B10TSHRCASP1
SCHEMBL1647345 0.72 CYP3A4 (0.30) CYP3A4
SCHEMBL27993900 0.71 CYP3A4 (0.47) CYP3A4HPGDHSD17B10TSHRCASP1

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