SCHEMBL9212964

SCHEMBL9212964

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

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.45
PTGS1 P23219 1/20 0.38

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
SCHEMBL9212585 0.93 ALOX5 (0.44) ALOX5PTGS1
SCHEMBL9049547 0.85 ALOX5 (0.48) ALOX5
SCHEMBL9221207 0.85 ALOX5 (0.49) ALOX5PTGS1
SCHEMBL9300222 0.84 ALOX5 (0.51) ALOX5PTGS1
SCHEMBL9037817 0.83 ALOX5 (0.46) ALOX5PTGS1
SCHEMBL9036795 0.83 ALOX5 (0.48) ALOX5PTGS1
SCHEMBL9301044 0.82 ALOX5 (0.47) ALOX5PTGS1
SCHEMBL9212956 0.82 ALOX5 (0.50) ALOX5
SCHEMBL9049483 0.82 ALOX5 (0.51) ALOX5
SCHEMBL9300219 0.81 ALOX5 (0.45) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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