SCHEMBL7466685

SCHEMBL7466685

FC(F)(F)c1cccc(COc2[c]cccc2-c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.47
IDO1 P14902 2/20 0.47
NR4A2 P43354 2/20 0.46
TACR1 P25103 1/20 0.45
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
PDGFRA P16234 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR5 Q9H228 1/20 0.41
PRKCA P17252 1/20 0.41
PRKCD Q05655 1/20 0.41

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
SCHEMBL7466725 0.86 RXRA (0.44) MAOBIDO1TACR1FFAR1FFAR4
SCHEMBL7460118 0.83 MAOB (0.43) MAOBIDO1NR4A2FFAR1
SCHEMBL7466776 0.82 GSTP1 (0.42) MAOBRXRARXRBRXRGMAPT
SCHEMBL7471019 0.81 MAOB (0.47) MAOBMRGPRX4THRATHRBMAPT
SCHEMBL7470974 0.81 PLA2G1B (0.44) MAOBIDO1NR4A2RXRARXRB
SCHEMBL7461083 0.79 MAOB (0.51) MAOBIDO1MRGPRX4
SCHEMBL4280169 0.76 PTGER1 (0.43) MAPT
SCHEMBL7455789 0.76 RXRA (0.43) MAOBNR4A2FFAR1FFAR4RXRA
SCHEMBL3321623 0.76 IDO1 (0.54) MAOBIDO1NR4A2FFAR1FFAR4
SCHEMBL7470952 0.75 IDO1 (0.45) MAOBIDO1TACR1FFAR1FFAR4

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