SCHEMBL4447158

SCHEMBL4447158

Clc1ccc(Cl)c(-c2c(Cl)cccc2Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
PNMT P11086 2/20 0.44
CYP1A2 P05177 4/20 0.43
CYP2A6 P11509 4/20 0.43
LMNA P02545 2/20 0.42
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
IDO1 P14902 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GLA P06280 1/20 0.38
MAPK1 P28482 1/20 0.38
CES1 P23141 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL29816658 1.00 TSHR (0.48) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL29915258 0.87 CYP3A4 (0.45) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL2933260 0.87 CYP3A4 (0.45) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL2471569 0.84 TSHR (0.57) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL4447012 0.81 NOTUM (0.42) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL30621941 0.81 NOTUM (0.42) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL4459139 0.80 ALDH1A1 (0.50) TSHRLMNACYP3A4ALDH1A1MAPK1
SCHEMBL29389611 0.80 ALDH1A1 (0.50) TSHRLMNACYP3A4ALDH1A1MAPK1
SCHEMBL4453792 0.80 TSHR (0.46) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL9731783 0.79 ALDH1A1 (0.45) TSHRPNMTCYP1A2CYP2A6LMNA

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