SCHEMBL7846076

SCHEMBL7846076

COc1ccc(Cc2ccc(OC)cc2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.52
CNR2 P34972 1/20 0.47
IDO1 P14902 1/20 0.45
SLC5A1 P13866 1/20 0.45
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44

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
SCHEMBL1539299 0.93 ACHE (0.48) LTA4HCNR2
SCHEMBL27557356 0.92 LTA4H (0.49) LTA4H
SCHEMBL28842002 0.91 LTA4H (0.55) LTA4HCNR2IDO1SLC5A1
SCHEMBL15719428 0.90 CYP19A1 (0.49) LTA4H
SCHEMBL11292183 0.89 LTA4H (0.58) LTA4HCYP11B1CYP11B2
SCHEMBL28302613 0.89 L3MBTL1 (0.50) LTA4HCNR2SLC5A1
SCHEMBL11295684 0.88 GPR84 (0.47) CNR2
SCHEMBL25005866 0.87 PABPC1 (0.44)
SCHEMBL7471697 0.86 MEN1 (0.46) LTA4HCNR2IDO1SLC5A1
SCHEMBL17141665 0.83 KCNJ1 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1150565-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION bioscience AG (DE) 2001-11-07 EP claimed
WO-2000045635-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2000-08-10 WO claimed
EP-1150565-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION bioscience AG (DE) 2001-11-07 EP disclosed
WO-2000045635-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2000-08-10 WO disclosed