SCHEMBL14343570

SCHEMBL14343570

O=C(O)CCCCCN/C(O)=C(/C(=O)NCC(=O)O)C(=O)NC1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 10/20 0.61
▸ EPHX2 P34913 5/20 0.53
▸ ALDH1A1 P00352 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL14343513 0.89 EPHX1 (0.57) EPHX1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL14343076 0.82 SMN1; SMN2 (0.50) EPHX1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL14343558 0.82 SMN1; SMN2 (0.50) EPHX1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL15741883 0.77 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL1065387 0.77 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL1066578 0.77 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL28612121 0.77 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL14342713 0.75 SMN1; SMN2 (0.42) EPHX1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL14342816 0.75 EPHX1 (0.50) EPHX1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL14342803 0.72 EPHX1 (0.54) EPHX1EPHX2ALDH1A1SMN1; 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
WO-2007150011-A2 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-12-27 — — WO disclosed
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