SCHEMBL8773240

SCHEMBL8773240

COc1cc(Br)nc(Oc2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.49
LMNA P02545 1/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HTT P42858 2/20 0.47
LTA4H P09960 1/20 0.47
MAPT P10636 5/20 0.45
MAPK1 P28482 3/20 0.45
HPGD P15428 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
ATM Q13315 1/20 0.45
PLA2G10 O15496 2/20 0.45
TDP1 Q9NUW8 1/20 0.44
CA4 P22748 1/20 0.43
NUDT1 P36639 1/20 0.43
NPSR1 Q6W5P4 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41

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
SCHEMBL19402595 0.87 MEN1 (0.47) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL7819657 0.81 ALDH1A1 (0.46) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL7107314 0.79 MAPT (0.52) L3MBTL1KMT2AMAPTMAPK1CYP1A2
SCHEMBL1415784 0.79 L3MBTL1 (0.49) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL8773216 0.78 MAOB (0.51) LMNAHTTNUDT1NPSR1ALDH1A1
SCHEMBL26262360 0.77 L3MBTL1 (0.43) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL24157009 0.75 LTA4H (0.55) L3MBTL1MEN1KMT2AHTTLTA4H
SCHEMBL19402597 0.75 MAPK1 (0.53) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL19325658 0.75 L3MBTL1 (0.51) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL4268518 0.75 LTA4H (0.60) L3MBTL1MEN1KMT2AHTTLTA4H

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