SCHEMBL9129041

SCHEMBL9129041

COC1(c2cc(F)cc(OCc3ccc4ccccc4c3)c2)CCC(=O)CC1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.75

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
Ethylene Glycol SCHEMBL9128501 0.96 ALOX5 (0.70) ALOX5
SCHEMBL9389838 0.89 ALOX5 (0.58) ALOX5
SCHEMBL9228198 0.86 ALOX5 (0.74) ALOX5
SCHEMBL9129191 0.86 ALOX5 (0.56) ALOX5
SCHEMBL9353041 0.86 ALOX5 (1.00) ALOX5
SCHEMBL9128605 0.85 ALOX5 (0.58) ALOX5
SCHEMBL9128568 0.85 ALOX5 (0.58) ALOX5
SCHEMBL9131415 0.84 ALOX5 (0.57) ALOX5
SCHEMBL9127217 0.84 ALOX5 (0.56) ALOX5
SCHEMBL9127208 0.84 ALOX5 (0.56) ALOX5

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
US-5407959-A Antiallergens, antiinflammatory agents ABBOTT LABORATORIES (US) 1995-04-18 US disclosed
WO-1994005638-A1 TRANS 1,4-DIETHER CYCLOHEXANE INHIBITORS OF 5-LIPOXYGENASE ABBOTT LABORATORIES (US) 1994-03-17 WO disclosed