SCHEMBL5283589

SCHEMBL5283589

O=C(Cl)c1cc(Cl)cc(C(=O)Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.46
AKR1C4 P17516 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
TPMT P51580 1/20 0.40
ALDH1A1 P00352 7/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 3/20 0.39
HPGD P15428 2/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MAOB P27338 1/20 0.37
TSHR P16473 3/20 0.37
ALOX15 P16050 1/20 0.36
DYRK1A Q13627 1/20 0.35
KDM4E B2RXH2 2/20 0.35
CASP1 P29466 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HCAR1 Q9BXC0 1/20 0.34

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
SCHEMBL1311328 0.87 ALDH1A1 (0.50) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL27508874 0.84 CYP3A4 (0.39) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL11629593 0.84 CYP3A4 (0.70) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL7538844 0.81 ALDH1A1 (0.34) CYP3A4TPMTALDH1A1MAOBTSHR
SCHEMBL1446799 0.79 ALDH1A1 (0.41) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL11627576 0.79 TMPRSS4 (0.39) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL1614777 0.78 CYP3A4 (0.71) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL31413031 0.77 GPR35 (0.47) CYP3A4ALDH1A1HPGDTSHRALOX15
SCHEMBL7902277 0.77 GPR35 (0.47) CYP3A4ALDH1A1HPGDTSHRALOX15
SCHEMBL11702911 0.76 CYP3A4 (0.34) CYP3A4AKR1C4AKR1C3AKR1C2AKR1C1

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-20070015896-A1 Dihydroxy aramid polymers E. I. DU PONT DE NEMOURS AND COMPANY 2007-01-18 US disclosed
WO-2007008889-A2 DIHYDROXY ARAMID POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-01-18 WO disclosed
EP-0113252-B1 PROCESS FOR PRODUCING BLOCK COPOLYAMIDE TORAY INDUSTRIES, INC. (JP) 1991-08-07 EP disclosed
US-4507465-A IMPACT STRENGTH TORAY INDUSTRIES, INC. (JP) 1985-03-26 US disclosed
EP-0113252-A2 Process for producing block copolyamide TORAY INDUSTRIES, INC. (JP) 1984-07-11 EP disclosed