SCHEMBL8773189

SCHEMBL8773189

COc1ccc(Oc2cc(C#N)cc(Cl)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.47
ESR1 P03372 3/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
HPGD P15428 1/20 0.45
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
HPGDS O60760 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.41
NPBWR1 P48145 1/20 0.41
MCHR1 Q99705 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MERTK Q12866 1/20 0.40

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
SCHEMBL24690169 0.84 GRM5 (0.51) GRM5MAPTHPGDKDM4EPOLB
SCHEMBL30020111 0.84 GRM5 (0.51) GRM5MAPTHPGDKDM4EPOLB
SCHEMBL23943606 0.83 GRM5 (0.43) GRM5MAPTKDM4EMAPK1L3MBTL1
SCHEMBL11296944 0.82 GRM5 (0.51) GRM5ALDH1A1KDM4EHPGDSLMNA
SCHEMBL18049170 0.81 GRM5 (0.51) GRM5ALDH1A1MAPTHPGDKDM4E
SCHEMBL20239278 0.80 PGR (0.47) GRM5ALDH1A1HPGDMAPK1MEN1
SCHEMBL16739535 0.78 MAPT (0.63) ESR1ALDH1A1MAPTHPGDKDM4E
SCHEMBL23504272 0.77 GRM5 (0.65) GRM5LMNASMN1; SMN2
SCHEMBL18249762 0.77 GRM5 (0.44) GRM5ESR1ALDH1A1KDM4EMEN1
SCHEMBL20239277 0.76 GRM5 (0.45) GRM5ESR1ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691277-A REACTING A 2,6-DIHALOGENOPYRIDINE WITH A META SUBSTITUTED PHENOL KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1997-11-25 US disclosed
EP-0692474-B1 2- (unsubstituted or substituted) (benzyloxy or phenoxy)-4-substituted-6-(meta-substituted phenoxy) pyridine, process for producing the same, and herbicidal composition KUREHA CHEMICAL IND CO LTD (JP) 1997-10-29 EP disclosed
EP-0692474-A1 2- (unsubstituted or substituted) (benzyloxy or phenoxy)-4-substituted-6-(meta-substituted phenoxy) pyridine, process for producing the same, and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-17 EP disclosed