SCHEMBL5159779

SCHEMBL5159779

Clc1cc(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.48
AHR P35869 3/20 0.42
CSNK2A1 P68400 2/20 0.40
MEN1 O00255 1/20 0.40
HSP90AA1 P07900 1/20 0.40
KMT2A Q03164 1/20 0.40
BACE1 P56817 1/20 0.39
NR1H2 P55055 1/20 0.37
ESR2 Q92731 1/20 0.36
METAP2 P50579 1/20 0.36
HTT P42858 2/20 0.36
MAP2 P11137 1/20 0.36
CYP1A2 P05177 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35

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
SCHEMBL29088510 0.82 CYP2A6 (0.43) CYP2A6AHRCSNK2A1MEN1HSP90AA1
SCHEMBL2936378 0.81 MEN1 (0.45) CYP2A6AHRMEN1HSP90AA1KMT2A
SCHEMBL2140618 0.80 CYP2A6 (0.50) CYP2A6AHRCSNK2A1MEN1HSP90AA1
SCHEMBL14060040 0.79 BACE1 (0.46) CYP2A6BACE1ESR2HTT
SCHEMBL29088506 0.78 CYP2A6 (0.43) CYP2A6AHRCSNK2A1MEN1HSP90AA1
SCHEMBL15655130 0.77 CYP1A2 (0.50) CYP2A6AHRMEN1HSP90AA1KMT2A
SCHEMBL404196 0.77 AHR (0.68) CYP2A6AHRCSNK2A1MEN1HSP90AA1
SCHEMBL29422942 0.77 AHR (0.68) CYP2A6AHRCSNK2A1MEN1HSP90AA1
SCHEMBL25369445 0.77 CYP2A6 (0.50) CYP2A6CSNK2A1MEN1KMT2ABACE1
SCHEMBL11314003 0.76 AHR (0.46) CYP2A6AHRCSNK2A1MEN1HSP90AA1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1751214-B1 AN IMPROVED PROCESS OF PREPARATION OF BLOCK COPOLYMERS AND THE BLOCK COPOLYMERS PREPARED THEREFROM SOLVAY SPECIALITIES INDIA PRIV (IN) 2007-10-10 EP claimed
CN-1942506-A Improved process for preparing block copolymers and block copolymers prepared thereby SOLVAY SPECIALITIES INDIA PRIV (IN) 2007-04-04 CN claimed
EP-1751214-A1 AN IMPROVED PROCESS OF PREPARATION OF BLOCK COPOLYMERS AND THE BLOCK COPOLYMERS PREPARED THEREFROM SOLVAY SPECIALITIES INDIA PRIVATE LIMITED (IN) 2007-02-14 EP claimed
WO-2005095491-A1 AN IMPROVED PROCESS OF PREPARATION OF BLOCK COPOLYMERS AND THE BLOCK COPOLYMERS PREPARED THEREFROM SOLVAY SPECIALITIES INDIA PRIVATE LIMITED (GB) 2005-10-13 WO claimed
US-20050228149-A1 Process of preparation of block copolymers and the block copolymers prepared therefrom TRIVEDI PRAKASH D 2005-10-13 US claimed
US-20140113093-A1 Polymers with reduced estrogenic activity SOLVAY SPECIALITY POLYMERS USA, LLC (US) 2014-04-24 US disclosed
WO-2012160172-A1 POLYMERS WITH REDUCED ESTROGENIC ACTIVITY SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2012-11-29 WO disclosed
EP-1751214-B1 AN IMPROVED PROCESS OF PREPARATION OF BLOCK COPOLYMERS AND THE BLOCK COPOLYMERS PREPARED THEREFROM SOLVAY SPECIALITIES INDIA PRIV (IN) 2007-10-10 EP disclosed
CN-1942506-A Improved process for preparing block copolymers and block copolymers prepared thereby SOLVAY SPECIALITIES INDIA PRIV (IN) 2007-04-04 CN disclosed
EP-1751214-A1 AN IMPROVED PROCESS OF PREPARATION OF BLOCK COPOLYMERS AND THE BLOCK COPOLYMERS PREPARED THEREFROM SOLVAY SPECIALITIES INDIA PRIVATE LIMITED (IN) 2007-02-14 EP disclosed
WO-2005095491-A1 AN IMPROVED PROCESS OF PREPARATION OF BLOCK COPOLYMERS AND THE BLOCK COPOLYMERS PREPARED THEREFROM SOLVAY SPECIALITIES INDIA PRIVATE LIMITED (GB) 2005-10-13 WO disclosed