SCHEMBL9050267

SCHEMBL9050267

COC1(c2cc(F)cc(Oc3ccc(C(C)=O)cc3)c2)CCOC1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
ESRRA P11474 1/20 0.33
BACE1 P56817 2/20 0.33
MAOB P27338 5/20 0.32
ALOX5 P09917 3/20 0.32
S1PR2 O95136 2/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
FFAR4 Q5NUL3 2/20 0.31
MAOA P21397 1/20 0.31

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
SCHEMBL9074809 0.88 POLB (0.30)
SCHEMBL9047979 0.83 GAA (0.33) GAA
SCHEMBL9049631 0.82 HPGD (0.39) MAPTHPGDSMN1; SMN2LMNAALOX5
SCHEMBL9048013 0.78 CHRNA1 (0.33)
SCHEMBL9046586 0.75 CA12 (0.32)
SCHEMBL9049077 0.72
SCHEMBL9047318 0.72 GAA (0.33) MAPTHPGDALOX5ALDH1A1GAA
SCHEMBL9050650 0.71 ALOX5 (0.53) MAPTHPGDSMN1; SMN2LMNAALOX5
SCHEMBL9051325 0.71 ALOX5 (0.31) ALOX5
SCHEMBL9076715 0.71 ALOX5 (0.31) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555068-B1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1996-04-10 EP disclosed
US-5482966-A LIPOXYGENASE ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS ZENECA LIMITED (GB) 1996-01-09 US disclosed
US-5332757-A Enzyme inhibitors ZENECA LIMITED (GB) 1994-07-26 US disclosed
EP-0555068-A1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed