SCHEMBL8698235

SCHEMBL8698235

COC1(c2cccc(O)c2F)CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 14/20 0.42
HDAC4 P56524 1/20 0.33
PDE1A P54750 1/20 0.32
PDE1B Q01064 1/20 0.32
PDE1C Q14123 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL8698520 0.85 ALOX5 (0.46) ALOX5
SCHEMBL9255827 0.79 ALOX5 (0.40) ALOX5
SCHEMBL8694243 0.79 ALOX5 (0.36) ALOX5PDE1APDE1BPDE1C
SCHEMBL8696312 0.79 ALOX5 (0.41) ALOX5
SCHEMBL8696283 0.74 ALOX5 (0.41) ALOX5
SCHEMBL8630367 0.73 ALOX5 (0.43) ALOX5
SCHEMBL2048287 0.73 TSHR (0.46) ALOX5CYP3A4
SCHEMBL8630364 0.70 ALOX5 (0.42) ALOX5
SCHEMBL3565566 0.69 OPRM1 (0.38) ALOX5CYP2C19
SCHEMBL1599480 0.69 ALOX5 (0.54) 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-5753682-A Imidazole lipoxygenase inhibitors PFIZER INC. (US) 1998-05-19 US disclosed
EP-0703913-B1 IMIDAZOLES AS LIPOXYGENASE INHIBITORS PFIZER (US) 1997-06-11 EP disclosed