1,3,5-Trichlorobenzene

1,3,5-Trichlorobenzene

SCHEMBL865477

Brc1cc(Br)cc(Br)c1.Clc1cc(Cl)cc(Cl)c1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
CYP3A4 P08684 3/20 0.44
TP53 P04637 1/20 0.44
ALDH1A1 P00352 2/20 0.39
IDO1 P14902 3/20 0.38
TPMT P51580 1/20 0.36
NMT1 P30419 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.35
AHR P35869 1/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33
ERN1 O75460 1/20 0.32
CYP2A6 P11509 2/20 0.31
LMNA P02545 1/20 0.31
GPR35 Q9HC97 1/20 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
SCHEMBL114694 0.92
SCHEMBL151031 0.92
SCHEMBL2590626 0.89 TSHR (0.57) TSHRCYP3A4TP53ALDH1A1IDO1
Hydrogen Sulfide SCHEMBL11480887 0.85 TSHR (0.44) TSHRCYP3A4TP53ALDH1A1IDO1
SCHEMBL1961699 0.81 TSHR (0.40) TSHRCYP3A4TP53
SCHEMBL1363469 0.79 PNMT (0.46) TSHRCYP3A4TP53IDO1HTR3E
SCHEMBL29897365 0.79 PNMT (0.46) TSHRCYP3A4TP53IDO1HTR3E
SCHEMBL24617 0.78
1,3,5-Trichlorobenzene SCHEMBL429512 0.78
SCHEMBL11658404 0.77 TSHR (0.36) TSHRNMT1

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
US-20120076984-A1 Biaxially Oriented Poly(Arylene Sulfide) Resin Film and Process for Production of Same KUREHA CORPORATION (JP) 2012-03-29 US disclosed