SCHEMBL7808973

SCHEMBL7808973

CCOC(=O)C1(c2cc(F)cc(OCc3ccccc3)c2)CCOCC1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 15/20 0.70
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
OPRM1 P35372 1/20 0.44

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
SCHEMBL7811102 0.91 ALOX5 (0.58) ALOX5LMNATSHROPRM1
SCHEMBL7810991 0.90 ALOX5 (0.57) ALOX5LMNATSHROPRM1
SCHEMBL7802551 0.87 ALOX5 (0.56) ALOX5
SCHEMBL9136129 0.87 ALOX5 (0.55) ALOX5OPRM1
SCHEMBL7810873 0.86 ALOX5 (0.67) ALOX5ALDH1A1LMNATSHRCYP2C19
SCHEMBL7811953 0.85 ALOX5 (0.66) ALOX5
SCHEMBL7815037 0.83 ALOX5 (1.00) ALOX5
SCHEMBL1600273 0.80 ALOX5 (0.55) ALOX5ALDH1A1LMNATSHRCYP2C19
SCHEMBL8551875 0.80 ALOX5 (0.59) ALOX5
SCHEMBL12707332 0.79 ALOX5 (0.52) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787127-B1 5-LIPOXYGENASE INHIBITORS PFIZER (US) 2001-01-03 EP disclosed
US-6063928-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, CARDIOTONIC AGENTS PFIZER INC (US) 2000-05-16 US disclosed
US-5883106-A 5-lipoxygenase inhibitors PFIZER INC. (US) 1999-03-16 US disclosed
EP-0787127-A1 5-LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1997-08-06 EP disclosed
WO-1996011911-A1 5-LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1996-04-25 WO disclosed