SCHEMBL8567928

SCHEMBL8567928

CCOC(=O)CCc1ccccc1-c1ccccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.63
CYP4A11 Q02928 3/20 0.63
ALDH1A1 P00352 2/20 0.56
GAA P10253 1/20 0.56
PTPN1 P18031 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
ALOX5 P09917 1/20 0.43
LMNA P02545 2/20 0.42

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
SCHEMBL18455674 0.91 CYP4F2 (0.71) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL18458202 0.88 CYP4F2 (0.67) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL1246063 0.87 CYP4F2 (0.76) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL8636007 0.84 CYP4F2 (0.61) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL69660 0.84 CYP4F2 (0.86) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL6282888 0.83 CYP4F2 (0.69) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL13921686 0.82 CYP4F2 (0.60) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL11410892 0.82 CYP4F2 (0.68) CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2
SCHEMBL8969442 0.82 CYP4F2 (0.68) CYP4F2CYP4A11ALDH1A1GAAPTPN1
SCHEMBL16318789 0.81 CYP4F2 (0.62) CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0544488-B1 Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1998-03-11 EP disclosed
CN-1035001-C Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1997-05-28 CN disclosed
EP-0743064-A1 Leukotriene antagonists for use in the treatment or prevention of alzheimer's disease ELI LILLY AND COMPANY (US) 1996-11-20 EP disclosed
US-5552441-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS AND RESPIRATORY SYSTEM DISORDERS ELI LILLY AND COMPANY (US) 1996-09-03 US disclosed
US-5462954-A Antiinflammatory, antiallergens; treating asthma ELI LILLY AND COMPANY (US) 1995-10-31 US disclosed
CN-1088906-A The phenyl phenol leukotriene antagonists that replaces LILLY CO ELI (US) 1994-07-06 CN disclosed
US-5324743-A Leukotriene B4 antagonists ELI LILLY AND COMPANY (US) 1994-06-28 US disclosed
EP-0544488-A2 Substituted phenyl phenol leukotriene antagonists ELI LILLY AND COMPANY (US) 1993-06-02 EP disclosed