SCHEMBL7092606

SCHEMBL7092606

Cc1cc(-c2ccccc2)ccc1CCOC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.44
PPARG P37231 3/20 0.43
PPARA Q07869 3/20 0.43
MGLL Q99685 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
RXRA P19793 2/20 0.40
RXRB P28702 2/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
RXRG P48443 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
PPARD Q03181 1/20 0.39
FAAH O00519 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DCLRE1A Q6PJP8 1/20 0.39

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
SCHEMBL7096241 0.83 ESR2 (0.46) PTGER4MGLLSMN1; SMN2DCLRE1ADCLRE1B
SCHEMBL7090979 0.82 MGLL (0.40) PTGER4PPARGPPARAMGLLMAPT
SCHEMBL10347904 0.80 ALOX5 (0.49) PPARGPPARACHRM5CHRM1KMT2A
SCHEMBL455471 0.75 MAPT (0.40) PPARGPPARARXRARXRBMAPT
SCHEMBL23403331 0.74 CYP1A2 (0.39) PPARGPPARAMRGPRX4RXRARXRB
SCHEMBL5263743 0.73 PDCD1 (0.48) PPARGPPARAMRGPRX4RXRARXRB
SCHEMBL28096697 0.72 HSD11B1 (0.45) MGLLSMN1; SMN2
SCHEMBL23399403 0.71 LMNA (0.37) PPARGPPARAMRGPRX4RXRARXRB
Biphenyl SCHEMBL17473096 0.71 LMNA (0.60) CHRM5CHRM1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL27850072 0.71 SLC1A3 (0.49) PPARGPPARASLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0970059-B1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER CROPSCIENCE AG (DE) 2003-08-20 EP disclosed
EP-0970059-A1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER AG (DE) 2000-01-12 EP disclosed
WO-1998039310-A1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER AKTIENGESELLSCHAFT (DE) 1998-09-11 WO disclosed