SCHEMBL7466725

SCHEMBL7466725

FC(F)(F)c1ccc(COc2[c]cccc2-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.44
RXRB P28702 2/20 0.44
RXRG P48443 2/20 0.44
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
TACR1 P25103 1/20 0.42
PTPN1 P18031 2/20 0.41
MAOB P27338 7/20 0.41
KIF11 P52732 1/20 0.41
IDO1 P14902 2/20 0.41
MAOA P21397 2/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.39
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38

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
SCHEMBL7466685 0.86 MAOB (0.47) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL7466776 0.85 GSTP1 (0.42) RXRARXRBRXRGMAOBMAOA
SCHEMBL7455789 0.85 RXRA (0.43) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL7460079 0.82 RXRA (0.40) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL7468369 0.82 IKBKB (0.48) RXRARXRBRXRGCYP19A1CYP11B1
SCHEMBL697658 0.80 MAOB (0.46) PTPN1MAOBIDO1MAOA
SCHEMBL7461463 0.80 ABCB1 (0.44) FFAR1FFAR4MAOB
SCHEMBL6754376 0.79 MAOB (0.51) MAOBIDO1MAOA
SCHEMBL7470952 0.78 IDO1 (0.45) FFAR1FFAR4TACR1MAOBIDO1
SCHEMBL7466994 0.78 MAOB (0.51) RXRARXRBRXRGFFAR1MAOB

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
EP-1244617-A1 SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE Ortho-McNeil Pharmaceutical, Inc. (US) 2002-10-02 EP claimed
WO-2001047875-A1 SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-07-05 WO claimed