SCHEMBL8773165

SCHEMBL8773165

N#Cc1cc(Cl)nc(OCc2ccccc2)c1

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.78
MAOB P27338 2/20 0.51
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
SQOR Q9Y6N5 1/20 0.44
CNR1 P21554 2/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
NUDT1 P36639 1/20 0.42
PRMT5 O14744 1/20 0.41
MRGPRX4 Q96LA9 2/20 0.41
EGLN2 Q96KS0 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL8963208 0.97 GRM5 (0.74) GRM5MAOBGABRG2GABRB3GABRA5
SCHEMBL31060977 0.87 GRM5 (1.00) GRM5MAOBCNR1CYP11B1CYP11B2
SCHEMBL4292772 0.87 GRM5 (1.00) GRM5MAOBCNR1CYP11B1CYP11B2
SCHEMBL4297770 0.83 GRM5 (1.00) GRM5GABRG2GABRB3GABRA5GABRA3
SCHEMBL8546238 0.81 GRM5 (0.64) GRM5CYP11B1CYP11B2
SCHEMBL4299839 0.80 GRM5 (1.00) GRM5CYP11B1CYP11B2MRGPRX4
SCHEMBL31287796 0.78 ALOX5 (0.50) GRM5MAOBNUDT1PRMT5MEN1
SCHEMBL14744985 0.78 ALOX5 (0.50) GRM5MAOBNUDT1PRMT5MEN1
SCHEMBL24690169 0.77 GRM5 (0.51) GRM5NUDT1MEN1KMT2A
SCHEMBL1901652 0.77 GRM5 (0.48) GRM5GABRG2GABRB3GABRA5GABRA3

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