SCHEMBL2934558

SCHEMBL2934558

Clc1ccc(-c2ccccc2Cl)c(Cl)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.52
S100A4 P26447 1/20 0.50
GPR3 P46089 1/20 0.48
CYP2A6 P11509 1/20 0.48
TP53 P04637 2/20 0.48
CRHR1 P34998 2/20 0.47
NPC1 O15118 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 2/20 0.47
PTPN1 P18031 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HSD11B1 P28845 3/20 0.46
DPP4 P27487 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL29416163 1.00 AHR (0.52) AHRS100A4GPR3CYP2A6TP53
SCHEMBL29624840 0.87 AHR (0.64) AHRS100A4TP53CRHR1ALDH1A1
SCHEMBL464507 0.87 AHR (0.64) AHRS100A4TP53CRHR1ALDH1A1
SCHEMBL29416774 0.85 PTPN1 (0.56) S100A4GPR3CYP2A6TP53ALDH1A1
SCHEMBL29983105 0.85 PTPN1 (0.56) S100A4GPR3CYP2A6TP53ALDH1A1
SCHEMBL381603 0.85 PTPN1 (0.56) S100A4GPR3CYP2A6TP53ALDH1A1
SCHEMBL4449749 0.84 AHR (0.52) AHRS100A4GPR3TP53CRHR1
SCHEMBL16424727 0.82 AHR (0.45) AHRS100A4GPR3TP53CRHR1
SCHEMBL2090401 0.82 AHR (0.45) AHRS100A4GPR3TP53CRHR1
SCHEMBL30883375 0.82 S100A4 (0.48) AHRS100A4GPR3TP53CRHR1

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 9 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
EP-3215476-B1 METHOD FOR PREPARATION OF FLUORO, CHLORO AND FLUOROCHLORO ALKYLATED COMPOUNDS BY HOMOGENEOUS CATALYSIS LONZA AG (CH) 2018-02-28 EP disclosed
EP-3126344-B1 METHOD FOR PREPARATION OF FLUORO, CHLORO AND FLUOROCHLORO ALKYLATED COMPOUNDS BY HETEROGENEOUS CATALYSIS LONZA AG (CH) 2017-08-09 EP disclosed
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 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
US-4806485-A PHOTOOXYGENATION COOPERATIVE INSTITUTE FOR RESEARCH IN ENVIRONMENTAL SCIENCES UNIVERS. OF COLORADO (US) 1989-02-21 US disclosed