SCHEMBL11239672

SCHEMBL11239672

Nc1ccc2oc(=O)n(CCCCCCCC(=O)O)c2c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 15/20 0.57
▸ ALDH1A1 P00352 2/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ APEX1 P27695 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL11137793 0.85 KMO (0.50) KMOALDH1A1NPSR1SMN1; SMN2
SCHEMBL11134988 0.85 KMO (0.81) KMO
SCHEMBL11133037 0.84 KMO (0.79) KMO
SCHEMBL11135147 0.81 ALDH1A1 (0.77) ALDH1A1NPSR1HPGDMAPK1SMN1; SMN2
SCHEMBL11139506 0.81 ALDH1A1 (0.77) ALDH1A1NPSR1HPGDMAPK1SMN1; SMN2
SCHEMBL11135151 0.81 KMO (0.56) KMOALDH1A1NPSR1APEX1
SCHEMBL11137490 0.80 ALDH1A1 (0.75) ALDH1A1NPSR1HPGDMAPK1SMN1; SMN2
SCHEMBL11135285 0.80 ALDH1A1 (0.75) ALDH1A1NPSR1HPGDMAPK1SMN1; SMN2
SCHEMBL11138199 0.80 KMO (0.55) KMOALDH1A1NPSR1APEX1
SCHEMBL11136597 0.77 MIF (0.55) KMOALDH1A1NPSR1APEX1

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
EP-0051827-A1 Omega-(2-oxo-benzimidazolinyl)-alkanoic acid derivatives, process for producing the same and pharmaceutical compounds containing the same A. Nattermann & Cie. GmbH (DE) 1982-05-19 — — EP claimed
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