SCHEMBL10808317

SCHEMBL10808317

CCCCCCCCCCCCNC(=O)NC(C)O

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.76
SMN1; SMN2 Q16637 1/20 0.62
CASP2 P42575 1/20 0.55
ASAH2 Q9NR71 1/20 0.52
CPT2 P23786 1/20 0.51
CPT1A P50416 1/20 0.51
CPT1B Q92523 1/20 0.51

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
SCHEMBL8342142 1.00 EPHX1 (0.76) EPHX1SMN1; SMN2CASP2ASAH2CPT2
SCHEMBL12196042 0.86 EPHX1 (1.00) EPHX1SMN1; SMN2
SCHEMBL25834895 0.86 EPHX1 (1.00) EPHX1SMN1; SMN2
SCHEMBL13777205 0.86 EPHX1 (1.00) EPHX1SMN1; SMN2
SCHEMBL27052608 0.86 EPHX1 (1.00) EPHX1SMN1; SMN2
SCHEMBL9784658 0.86 EPHX1 (1.00) EPHX1SMN1; SMN2
SCHEMBL1896879 0.84 EPHX1 (0.96) EPHX1SMN1; SMN2CPT2CPT1ACPT1B
SCHEMBL25853703 0.83 EPHX1 (0.73) EPHX1SMN1; SMN2CPT2CPT1ACPT1B
SCHEMBL11780964 0.83 EPHX1 (0.73) EPHX1SMN1; SMN2CPT2CPT1ACPT1B
SCHEMBL4587111 0.81 EPHX1 (0.71) EPHX1SMN1; SMN2CPT2CPT1ACPT1B

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-4710580-A ANTIALLERGENS; ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1987-12-01 US disclosed