SCHEMBL10732007

SCHEMBL10732007

CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)CC1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.77
SMN1; SMN2 Q16637 5/20 0.77
MAPT P10636 5/20 0.77
HTT P42858 4/20 0.77
LMNA P02545 10/20 0.76
POLB P06746 1/20 0.76
GAA P10253 1/20 0.75
PAX8 Q06710 2/20 0.61
CYP1A2 P05177 2/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2C9 P11712 2/20 0.59
CYP2C19 P33261 2/20 0.59
RAB9A P51151 1/20 0.59
MEN1 O00255 1/20 0.59
CYP2D6 P10635 1/20 0.59
KMT2A Q03164 1/20 0.59
KDM4E B2RXH2 2/20 0.57
NPC1 O15118 1/20 0.56

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
SCHEMBL10732490 0.90 ALDH1A1 (0.77) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL10726821 0.89 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL10727874 0.89 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL10726572 0.88 HTT (0.65) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL10726195 0.87 LMNA (0.80) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL1672017 0.87 HTT (1.00) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL27954071 0.86 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL10729946 0.85 HTT (0.68) ALDH1A1SMN1; SMN2MAPTHTTLMNA
Methyl Alcohol SCHEMBL28334259 0.85 ALDH1A1 (0.98) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL10732027 0.84 HTT (0.67) ALDH1A1SMN1; SMN2MAPTHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4680402-A Benzoyl-phenyl-piperidine derivatives SOCIETE DE RECHERCHES INDUSTRIELLES (S.O.R.I.) (FR) 1987-07-14 US disclosed