SCHEMBL9565518

SCHEMBL9565518

CCCCOC(=O)NC(CC(=O)O)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.44
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EPHX1 P07099 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 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
SCHEMBL7404539 0.87 ACHE (0.46) ACHEEPHX1
SCHEMBL8141861 0.85 EPHX1 (0.44) ACHENPC1RAB9ASMN1; SMN2EPHX1
SCHEMBL4685971 0.85 SIRT2 (0.43) NPC1RAB9ASMN1; SMN2EPHX1
SCHEMBL7812490 0.84 SIRT2 (0.44) ACHENPC1RAB9ASMN1; SMN2EPHX1
SCHEMBL24096149 0.83 EPHX1 (0.51) ACHEEPHX1
SCHEMBL7278916 0.83 RAB9A (0.42) ACHENPC1RAB9ASMN1; SMN2EPHX1
SCHEMBL7278909 0.83 RAB9A (0.42) ACHENPC1RAB9ASMN1; SMN2EPHX1
SCHEMBL17099347 0.82 ACHE (0.41) ACHEEPHX1
SCHEMBL18699093 0.82 ACHE (0.53) ACHENPC1RAB9ASMN1; SMN2EPHX1
SCHEMBL8872226 0.81 ECE1 (0.43) ACHENPC1RAB9ASMN1; SMN2EPHX1

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-0574135-A1 Process for producing peptide derivatives and salts thereof JAPAN ENERGY CORPORATION (JP) 1993-12-15 EP disclosed