SCHEMBL8749252

SCHEMBL8749252

COC(=O)C(C)Oc1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.50
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
STK39 Q9UEW8 1/20 0.47
MRGPRX4 Q96LA9 6/20 0.47
MEN1 O00255 1/20 0.47
TTR P02766 1/20 0.47
PPOX P50336 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2C9 P11712 1/20 0.46
ATM Q13315 1/20 0.46
HTR2A P28223 1/20 0.45

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
SCHEMBL732095 0.91 FFAR1 (0.58) FFAR1MAPTL3MBTL1MRGPRX4MEN1
SCHEMBL8749291 0.90 FFAR1 (0.49) FFAR1MAPTMRGPRX4MEN1TTR
SCHEMBL11258317 0.90 FFAR1 (0.54) FFAR1MAPTL3MBTL1MRGPRX4MEN1
SCHEMBL11119306 0.89 FFAR1 (0.51) FFAR1MAPTL3MBTL1NPSR1STK39
SCHEMBL147772 0.89 FFAR1 (0.51) FFAR1MAPTL3MBTL1MRGPRX4MEN1
SCHEMBL941173 0.89 FFAR1 (0.51) FFAR1MAPTL3MBTL1MRGPRX4MEN1
SCHEMBL29382403 0.89 FFAR1 (0.51) FFAR1MAPTL3MBTL1MRGPRX4MEN1
SCHEMBL10615272 0.88 FFAR1 (0.58) FFAR1MAPTL3MBTL1NPSR1STK39
SCHEMBL11442480 0.88 FFAR1 (0.52) FFAR1MAPTL3MBTL1MRGPRX4MEN1
SCHEMBL9572361 0.87 MAPT (0.49) FFAR1MAPTL3MBTL1NPSR1KDM4E

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-0768085-A1 ANTIBACTERIAL AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-04-16 EP disclosed
EP-0761215-A1 ANTIBACTERIAL AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-03-12 EP disclosed