SCHEMBL7075868

SCHEMBL7075868

NC(=O)N(SC1CCCCC1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.37
EPHX1 P07099 1/20 0.33
KMT2A Q03164 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL7075875 0.90 ALOX5 (0.41) ALOX5EPHX1KMT2ACES2CES1
SCHEMBL3073660 0.82 ALOX5 (0.36) ALOX5EPHX1KMT2A
SCHEMBL18966016 0.72 ALOX5 (0.37) ALOX5EPHX1CES2CES1
SCHEMBL3075878 0.71 MGLL (0.35) ALOX5CES2CES1
SCHEMBL6832484 0.69 EPHX1 (0.34) ALOX5EPHX1CES2CES1
SCHEMBL3073554 0.67
SCHEMBL10993667 0.67 KMT2A (0.37) EPHX1KMT2A
SCHEMBL3081858 0.65 EPHX1 (0.35) ALOX5EPHX1
SCHEMBL3068219 0.65 ACHE (0.35)
SCHEMBL20623601 0.64 EPHX1 (0.41) ALOX5EPHX1KMT2ACES2CES1

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-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed