SCHEMBL11435944

SCHEMBL11435944

Cn1cc(-c2ccc(OCc3ccccc3)cc2)c(=O)c(-c2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 2/20 0.50
GPR34 Q9UPC5 1/20 0.50
NR4A2 P43354 1/20 0.48
MAOB P27338 6/20 0.47
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
PDGFRA P16234 1/20 0.45
S1PR1 P21453 1/20 0.45
S1PR5 Q9H228 1/20 0.45
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
PPARD Q03181 1/20 0.43
ADAMTS4 O75173 1/20 0.43
MMP13 P45452 1/20 0.43
ADAMTS5 Q9UNA0 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
Fluridone SCHEMBL54579 0.85 BRD9 (0.43) MAOBMAPT
Fluridone SCHEMBL6751451 0.85 BRD9 (0.43) MAOBMAPT
SCHEMBL11428028 0.83 NR1H4 (0.49) MAOBMAPTL3MBTL1
SCHEMBL11439970 0.83 GSTP1 (0.54) GSTP1NR4A2MAOBMRGPRX4
SCHEMBL11426704 0.81 BRD9 (0.43) MAOB
SCHEMBL11433951 0.81 BRD9 (0.46) MAOBMMP13MAPT
SCHEMBL11441223 0.81 ALOX15 (0.44) S1PR5MAPT
SCHEMBL11434477 0.79 MAPT (0.45) FFAR1FFAR4MAPT
SCHEMBL11428587 0.79 PGR (0.43) MAOBMAPT
SCHEMBL11434638 0.79 CXCR2 (0.41) S1PR5MAPT

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
US-4235619-A USING 3-PHENYL-4(1H)-PYRIDONES OR PYRIDINETHIONES ELI LILLY AND COMPANY (US) 1980-11-25 US disclosed
US-4152136-A HERBICIDES ELI LILLY AND COMPANY (US) 1979-05-01 US disclosed