SCHEMBL9310967

SCHEMBL9310967

CCOC(=O)C1CCCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
MAPT P10636 5/20 0.46
POLB P06746 3/20 0.46
KDM4E B2RXH2 3/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 4/20 0.46
HPGD P15428 1/20 0.46
MEN1 O00255 3/20 0.43
THRB P10828 1/20 0.43
FKBP1A P62942 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
F2 P00734 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RCE1 Q9Y256 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
SCHEMBL9308216 0.84 MAPT (0.44) ALDH1A1MAPTPOLBKDM4EKMT2A
SCHEMBL18556235 0.76 MAPT (0.56) ALDH1A1MAPTPOLBKDM4ERECQL
SCHEMBL14904738 0.76 MAPT (0.56) ALDH1A1MAPTPOLBKDM4ERECQL
SCHEMBL11697405 0.76 ALDH1A1 (0.56) ALDH1A1MAPTPOLBKDM4ERECQL
SCHEMBL6331720 0.76 ALDH1A1 (0.63) ALDH1A1POLBKDM4EKMT2AHPGD
SCHEMBL17929301 0.74 CNR2 (0.42) ALDH1A1MAPTKMT2AFKBP1A
SCHEMBL13469117 0.72 ALDH1A1 (0.54) ALDH1A1POLBKDM4EKMT2AMEN1
SCHEMBL9310097 0.72 MAPT (0.41) ALDH1A1MAPTPOLBKDM4ERECQL
SCHEMBL20366865 0.72 ALDH1A1 (0.56) ALDH1A1KDM4EKMT2AMEN1FKBP1A
SCHEMBL17929299 0.71 FKBP1A (0.43) ALDH1A1MAPTKMT2AFKBP1ASMN1; SMN2

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-5332735-A Antiamnesic activity ADIR ET COMPAGNIE (FR) 1994-07-26 US disclosed