SCHEMBL4453792

SCHEMBL4453792

Clc1cc(Cl)c(Cl)c(-c2c(Cl)cccc2Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
CASP1 P29466 1/20 0.46
CYP3A4 P08684 2/20 0.45
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2A6 P11509 1/20 0.41
LMNA P02545 2/20 0.40
AHR P35869 5/20 0.39
PNMT P11086 1/20 0.37
NR4A2 P43354 1/20 0.37
HSP90AA1 P07900 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
USP2 O75604 1/20 0.36
EGFR P00533 1/20 0.36
ESR1 P03372 1/20 0.36

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
SCHEMBL4448496 0.84 CYP3A4 (0.48) TSHRHPGDHSD17B10CASP1CYP3A4
SCHEMBL4452908 0.82 CYP1A2 (0.45) TSHRCYP3A4ALDH1A1CYP1A2CYP2A6
SCHEMBL4452692 0.82 CYP3A4 (0.64) TSHRHPGDHSD17B10CASP1CYP3A4
SCHEMBL2471569 0.82 TSHR (0.57) TSHRALDH1A1CYP1A2CYP2A6LMNA
SCHEMBL23827191 0.80 CYP3A4 (0.47) TSHRHPGDHSD17B10CASP1CYP3A4
SCHEMBL30542156 0.80 CYP3A4 (0.47) TSHRHPGDHSD17B10CASP1CYP3A4
SCHEMBL29816658 0.80 TSHR (0.48) TSHRCYP3A4ALDH1A1MAPK1CYP1A2
SCHEMBL4447158 0.80 TSHR (0.48) TSHRCYP3A4ALDH1A1MAPK1CYP1A2
SCHEMBL4453481 0.77 NOTUM (0.41) TSHRCYP3A4ALDH1A1MAPK1CYP1A2
SCHEMBL4456478 0.77 ALDH1A1 (0.65) TSHRHPGDHSD17B10CASP1CYP3A4

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
EP-3881907-A1 METHOD FOR DECHLORINATION OF ONE OR MORE AROMATIC ORGANOCHLORINE COMPOUND(S) CONTAINED IN AN OIL OR FORMING SAID OIL - ASSOCIATED ELECTRICAL/ELECTRONIC DEVICE AND INSTALLATION Université de Lille (FR) 2021-09-22 EP claimed
EP-3881907-A1 METHOD FOR DECHLORINATION OF ONE OR MORE AROMATIC ORGANOCHLORINE COMPOUND(S) CONTAINED IN AN OIL OR FORMING SAID OIL - ASSOCIATED ELECTRICAL/ELECTRONIC DEVICE AND INSTALLATION Université de Lille (FR) 2021-09-22 EP disclosed
US-20090269857-A1 Instruments for detecting low-molecular weight substance FUJIKURA KASEI CO., LTD. (JP) 2009-10-29 US disclosed
US-20050148097-A1 Instruments for detecting low-molecular weight substance ENBIOTEC LABORATORIES C., LTD. (JP) 2005-07-07 US disclosed
EP-1489420-A1 INSTRUMENTS FOR DETECTING LOW-MOLECULAR WEIGHT SUBSTANCE Enbiotec Laboratories Co., Ltd. (JP) 2004-12-22 EP disclosed