SCHEMBL8796322

SCHEMBL8796322

CC1(C)CCC(C)(C)c2cc(CCC=C(CCC(=O)O)c3cccc(C(F)(F)F)c3)ccc21

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP26B1 Q9NR63 6/20 0.47
CYP26A1 O43174 6/20 0.47
PLA2G4A P47712 1/20 0.43
FFAR4 Q5NUL3 4/20 0.41
FFAR1 O14842 3/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
CYP3A4 P08684 2/20 0.40
TBXAS1 P24557 1/20 0.39
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39
GAA P10253 1/20 0.37
CYP2C19 P33261 1/20 0.37
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36

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
SCHEMBL8796315 1.00 CYP26B1 (0.47) CYP26B1CYP26A1PLA2G4AFFAR4FFAR1
SCHEMBL8796319 1.00 CYP26B1 (0.47) CYP26B1CYP26A1PLA2G4AFFAR4FFAR1
SCHEMBL8795252 0.88 PLA2G4A (0.43) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795259 0.88 PLA2G4A (0.43) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795256 0.88 PLA2G4A (0.43) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795367 0.87 PLA2G4A (0.40) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795359 0.87 PLA2G4A (0.40) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795639 0.85 PLA2G4A (0.52) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795635 0.85 PLA2G4A (0.52) CYP26B1CYP26A1PLA2G4ARXRARXRB
SCHEMBL8795905 0.85 PLA2G4A (0.42) CYP26B1CYP26A1PLA2G4AFFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0629604-B1 Alicyclic phospholipase A2 inhibitors BRISTOL MYERS SQUIBB CO (US) 1997-04-16 EP claimed
US-5436369-A Alicyclic phospholipase A2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-25 US claimed
EP-0629604-A2 Alicyclic phospholipase A2 inhibitors Bristol-Myers Company (US) 1994-12-21 EP claimed
EP-0629604-B1 Alicyclic phospholipase A2 inhibitors BRISTOL MYERS SQUIBB CO (US) 1997-04-16 EP disclosed
US-5436369-A Alicyclic phospholipase A2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-25 US disclosed
EP-0629604-A2 Alicyclic phospholipase A2 inhibitors Bristol-Myers Company (US) 1994-12-21 EP disclosed