SCHEMBL9636348

SCHEMBL9636348

CC(=O)Nc1ccc(Cc2ccccn2)c([N+](=O)[O-])c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
ATM Q13315 1/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 4/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
PKM P14618 1/20 0.42
GPR39 O43194 1/20 0.42
AURKB Q96GD4 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 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
SCHEMBL194683 0.87 LMNA (0.47) HTTMEN1KMT2ARAB9ANPC1
SCHEMBL9636354 0.85 MEN1 (0.46) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL9637327 0.84 LMNA (0.48) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL9636320 0.83 LMNA (0.47) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL9636356 0.79 PKM (0.45) HTTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL359006 0.78 HTT (0.64) HTTMEN1KMT2ARAB9ANPC1
SCHEMBL11425242 0.78 ALDH1A1 (0.56) SMN1; SMN2MAPTMAPK1LMNAALDH1A1
SCHEMBL9637607 0.78 PKM (0.44) HTTSMN1; SMN2L3MBTL1MAPTMAPK1
SCHEMBL9636106 0.78 PKM (0.44) HTTSMN1; SMN2L3MBTL1MAPTMAPK1
SCHEMBL5159572 0.77 CYP1A2 (0.52) HTTMEN1KMT2ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0303232-B1 USE OF BENZYLPYRIDINE DERIVATIVES IN THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF DEMENTIA KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-07-29 EP claimed
EP-0303232-A2 Use of benzylpyridine derivatives in the manufacture of a medicament for the treatment of dementia KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-02-15 EP claimed
JP-1042431-A None JP disclosed
EP-0303232-B1 USE OF BENZYLPYRIDINE DERIVATIVES IN THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF DEMENTIA KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-07-29 EP disclosed
US-4851414-A AMIDO NITRO BENZYLPYRIDINES KYOWA HAKKO KAGYO CO., LTD. (JP) 1989-07-25 US disclosed
EP-0303232-A2 Use of benzylpyridine derivatives in the manufacture of a medicament for the treatment of dementia KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-02-15 EP disclosed
JP-S6442431-A ANTIDEMENT AGENT KYOWA HAKKO KOGYO KK 1989-02-14 JP disclosed