SCHEMBL4628852

SCHEMBL4628852

COc1ccc(C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.46
CYP11B1 P15538 2/20 0.46
CYP11B2 P19099 2/20 0.46
AR P10275 4/20 0.46
PGR P06401 2/20 0.46
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
CYP26A1 O43174 1/20 0.40
CYP24A1 Q07973 1/20 0.40

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
SCHEMBL8225493 0.90 CA1 (0.48) EPHX2CYP11B1CYP11B2ARPGR
SCHEMBL22140448 0.83 EPHX2 (0.43) EPHX2CYP11B1CYP11B2ARPGR
SCHEMBL2900162 0.83 EPHX2 (0.44) EPHX2CYP11B1CYP11B2ARPGR
SCHEMBL21446957 0.83 CYP11B1 (0.44) EPHX2CYP11B1CYP11B2ARPGR
SCHEMBL29775318 0.83 CA12 (0.56) EPHX2ARPGRCA12CA1
SCHEMBL7909509 0.83 CA12 (0.56) CYP11B1CYP11B2ARPGRCA12
SCHEMBL756255 0.83 PTPN7 (0.50) EPHX2CYP11B1CYP11B2ARPGR
SCHEMBL15305003 0.83 CYP11B2 (0.59) EPHX2CYP11B1CYP11B2ARPGR
SCHEMBL31193485 0.83 CA12 (0.56) CYP11B1CYP11B2ARPGRCA12
SCHEMBL29775423 0.83 PTPN7 (0.50) EPHX2CYP11B1CYP11B2ARPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1917239-A1 FLUOROPROSTAGLANDINS NITRODERIVATIVES Pfizer, Inc. (US) 2008-05-07 EP claimed
WO-2007000642-A1 FLUOROPROSTAGLANDINS NITRODERIVATIVES PFIZER INC. (US) 2007-01-04 WO claimed
EP-1917239-A1 FLUOROPROSTAGLANDINS NITRODERIVATIVES Pfizer, Inc. (US) 2008-05-07 EP disclosed
WO-2007000642-A1 FLUOROPROSTAGLANDINS NITRODERIVATIVES PFIZER INC. (US) 2007-01-04 WO disclosed
EP-0930296-B2 FLUORINATED PROSTAGLANDIN DERIVATIVES AND MEDICINES ASAHI GLASS CO LTD (JP) 2005-11-02 EP disclosed
EP-0850926-B1 Difluoroprostaglandin derivatives and their use ASAHI GLASS CO LTD (JP) 2002-10-09 EP disclosed
EP-0930296-B1 FLUORINATED PROSTAGLANDIN DERIVATIVES AND MEDICINES ASAHI GLASS CO LTD (JP) 2002-07-24 EP disclosed
US-5985920-A COMPOUNDS FOR TREATMENT OF VISION DEFECTS SUCH AS GLAUCOMA ASAHI GLASS COMPANY LTD. (JP) 1999-11-16 US disclosed
EP-0930296-A1 FLUORINATED PROSTAGLANDIN DERIVATIVES AND MEDICINES ASAHI GLASS COMPANY LTD. (JP) 1999-07-21 EP disclosed
US-5886035-A PREVENTIVE AND THERAPEUTICAL MEDICINE FOR EYE DISEASE ASAHI GLASS COMPANY LTD. (JP) 1999-03-23 US disclosed
EP-0850926-A2 Difluoroprostaglandin derivatives and their use ASAHI GLASS COMPANY LTD. (JP) 1998-07-01 EP disclosed