SCHEMBL9565516

SCHEMBL9565516

CCCCOC(=O)NOC(=O)CCC(N)=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
EPHX1 P07099 1/20 0.43
NPC1 O15118 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ACHE P22303 13/20 0.42
HTR2C P28335 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ATM Q13315 1/20 0.39

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
SCHEMBL11525727 0.93 EPHX1 (0.48) RAB9AEPHX1NPC1SMN1; SMN2ACHE
SCHEMBL7256775 0.88 EPHX1 (0.47) RAB9AEPHX1NPC1SMN1; SMN2ACHE
SCHEMBL6223307 0.86 DGKA (0.53) EPHX1ACHEHTR2CALDH1A1MAPT
SCHEMBL6946859 0.85 DGKA (0.56) EPHX1ACHEHTR2CMAPT
SCHEMBL3664894 0.82 NAAA (0.52) RAB9AEPHX1NPC1SMN1; SMN2ACHE
SCHEMBL7149699 0.82 HTR2C (0.58) RAB9AHTR2CALDH1A1MAPTNPSR1
SCHEMBL11525493 0.81 EPHX1 (0.58) EPHX1ACHEHTR2C
SCHEMBL8973569 0.81 EPHX1 (0.58) EPHX1ACHEHTR2C
SCHEMBL11532760 0.81 EPHX1 (0.58) EPHX1ACHEHTR2C
SCHEMBL11522408 0.81 EPHX1 (0.58) EPHX1ACHEHTR2C

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