SCHEMBL4449783

SCHEMBL4449783

Clc1ccccc1-c1c(Cl)c(Cl)cc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.48
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
CYP3A4 P08684 1/20 0.41
DPP4 P27487 1/20 0.40
PLA2G7 Q13093 1/20 0.39
ALDH1A1 P00352 3/20 0.39
AHR P35869 1/20 0.39
HSD11B1 P28845 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
IDO1 P14902 1/20 0.38
NOTUM Q6P988 1/20 0.36
PTPRC P08575 1/20 0.36
LDHA P00338 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
SCHEMBL29682856 1.00 CYP2A6 (0.48) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL4453386 0.86 CYP2A6 (0.44) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL30621943 0.86 CYP2A6 (0.44) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL308792 0.84 CYP2A6 (0.52) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL4453481 0.83 NOTUM (0.41) CYP2A6TSHRCYP3A4ALDH1A1AHR
SCHEMBL8603078 0.80 CYP2A6 (0.36) CYP2A6HPGDALDH1A1HSD11B1HSP90AA1
SCHEMBL30378025 0.80 CYP2A6 (0.48) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL4459058 0.80 CYP2A6 (0.48) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL4450486 0.77 CYP2A6 (0.50) CYP2A6LMNATSHRNPC1RAB9A
SCHEMBL29387186 0.77 CYP2A6 (0.50) CYP2A6LMNATSHRNPC1RAB9A

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 4 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
EP-1489420-A1 INSTRUMENTS FOR DETECTING LOW-MOLECULAR WEIGHT SUBSTANCE Enbiotec Laboratories Co., Ltd. (JP) 2004-12-22 EP disclosed