SCHEMBL9213730

SCHEMBL9213730

COC1(c2cc(F)cc(Sc3ccc(C(C)ONC(N)=O)cc3)c2)CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 0.44
PTGS1 P23219 1/20 0.36

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
SCHEMBL9301044 0.93 ALOX5 (0.47) ALOX5PTGS1
SCHEMBL9252559 0.83 ALOX5 (0.44) ALOX5PTGS1
SCHEMBL9037267 0.83 ALOX5 (0.44) ALOX5PTGS1
SCHEMBL9258722 0.82 ALOX5 (0.42) ALOX5PTGS1
SCHEMBL9212585 0.82 ALOX5 (0.44) ALOX5PTGS1
SCHEMBL9036639 0.82 ALOX5 (0.46) ALOX5PTGS1
SCHEMBL9047341 0.81 ALOX5 (0.43) ALOX5PTGS1
SCHEMBL9035202 0.81 ALOX5 (0.43) ALOX5PTGS1
SCHEMBL9212677 0.81 ALOX5 (0.42) ALOX5PTGS1
SCHEMBL9048169 0.81 ALOX5 (0.46) ALOX5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5334614-A Lipoxygenase inhibitor ZENECA LTD. (GB) 1994-08-02 US claimed
EP-0570197-B1 Hydroxylamine derivatives ZENECA LTD (GB) 1995-12-13 EP disclosed
US-5334614-A Lipoxygenase inhibitor ZENECA LTD. (GB) 1994-08-02 US disclosed
EP-0570197-A1 Hydroxylamine derivatives ZENECA LIMITED (GB) 1993-11-18 EP disclosed