SCHEMBL11348786

SCHEMBL11348786

CCCCCCCCCCCCN[C@H](C(=O)O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.54
EPHX1 P07099 3/20 0.49
ALDH1A1 P00352 2/20 0.49
HTT P42858 1/20 0.49
ASAH1 Q13510 2/20 0.48
ACER2 Q5QJU3 1/20 0.47

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
SCHEMBL11531764 1.00 NAAA (0.57) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL6126665 1.00 NAAA (0.57) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL11348782 1.00 NAAA (0.57) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL5243467 1.00 NAAA (0.57) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL3404981 1.00 NAAA (0.57) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL9780637 1.00 NAAA (0.57) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL1668081 0.98 NAAA (0.55) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL16107540 0.98 NAAA (0.55) NAAASMN1; SMN2EPHX1ALDH1A1HTT
SCHEMBL11349018 0.93 SMN1; SMN2 (0.56) NAAASMN1; SMN2ALDH1A1HTTASAH1
SCHEMBL12159279 0.93 SMN1; SMN2 (0.56) NAAASMN1; SMN2ALDH1A1HTTASAH1

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-4248677-A ELECTROCHEMICAL REDUCTION OF IMINES TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1981-02-03 US disclosed