SCHEMBL9505341

SCHEMBL9505341

CN(O)C(=O)NCCc1ccc2cc(OCc3ccc4ccccc4n3)ccc2c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.62
CYSLTR1 Q9Y271 9/20 0.54
FFAR1 O14842 1/20 0.53
AKR1B1 P15121 1/20 0.53

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
SCHEMBL9505352 0.83 ALOX5 (0.85) ALOX5CYSLTR1FFAR1AKR1B1
SCHEMBL9666803 0.80 CES2 (0.53)
SCHEMBL9504046 0.79 ALOX5 (0.58) ALOX5CYSLTR1FFAR1AKR1B1
SCHEMBL7806985 0.79 CYSLTR1 (0.60) ALOX5CYSLTR1FFAR1AKR1B1
SCHEMBL9584619 0.78 ALOX5 (0.58) ALOX5CYSLTR1
SCHEMBL9505339 0.78 ALOX5 (0.58) ALOX5CYSLTR1
SCHEMBL7808132 0.78 ALOX5 (0.63) ALOX5CYSLTR1FFAR1AKR1B1
SCHEMBL10692490 0.77 ALOX5 (1.00) ALOX5CYSLTR1FFAR1AKR1B1
SCHEMBL7807149 0.76 FFAR1 (0.68) ALOX5CYSLTR1FFAR1AKR1B1
SCHEMBL10692276 0.76 ALOX5 (1.00) ALOX5CYSLTR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0547148-A1 NAPHTHALENEPROPIONIC ACID DERIVATIVES AS ANTI-INFLAMMATORY/ANTIALLERGIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-06-23 EP claimed
WO-1992004325-A1 NAPHTHALENEPROPIONIC ACID DERIVATIVES AS ANTI-INFLAMMATORY/ANTIALLERGIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-03-19 WO claimed