SCHEMBL9636320

SCHEMBL9636320

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 2/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 2/20 0.44
SAE1 Q9UBE0 1/20 0.44
UBA2 Q9UBT2 1/20 0.44
HPGD P15428 1/20 0.43
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL9636185 1.00 LMNA (0.47) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL9637327 0.99 LMNA (0.48) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL9636354 0.96 MEN1 (0.46) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL194683 0.92 LMNA (0.47) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9637607 0.84 PKM (0.44) LMNASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL9636106 0.84 PKM (0.44) LMNASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL9636348 0.83 HTT (0.53) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9636356 0.83 PKM (0.45) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL10033424 0.76 ALDH1A1 (0.54) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL11257514 0.75 MEN1 (0.57) LMNANPC1RAB9ASMN1; SMN2MEN1

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 5 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
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