SCHEMBL6676697

SCHEMBL6676697

Cc1cc(-c2ccc(C(C)C)c(C(C)C)c2-c2cc(C)c(O)c(C)c2)cc(C)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
LMNA P02545 4/20 0.37
SLC6A2 P23975 2/20 0.37
HTR2B P41595 2/20 0.37
TRPA1 O75762 1/20 0.37
CHRM1 P11229 1/20 0.37
ADRA1A P35348 1/20 0.37
LDHA P00338 2/20 0.35
LDHB P07195 2/20 0.35
GABRA1 P14867 4/20 0.35
GABRB1 P18505 4/20 0.35
PTGS1 P23219 3/20 0.35
PTGS2 P35354 2/20 0.35
BCL2 P10415 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MCL1 Q07820 1/20 0.35
BCL2L2 Q92843 1/20 0.35
RPS6KA3 P51812 1/20 0.34
GABRB2 P47870 2/20 0.33

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
SCHEMBL1885197 0.87 CA1 (0.41) CA1CA2LMNASLC6A2HTR2B
SCHEMBL758758 0.81 CA1 (0.52) CA1CA2LMNASLC6A2HTR2B
SCHEMBL4134974 0.80 CA1 (0.34) CA1CA2LMNASLC6A2HTR2B
SCHEMBL27509265 0.79 CA1 (0.47) CA1CA2LMNASLC6A2HTR2B
SCHEMBL3661100 0.77 CA1 (0.56) CA1CA2LMNATRPA1LDHA
SCHEMBL8895164 0.75 CA1 (0.54) CA1CA2LMNAPTGS1PTGS2
SCHEMBL3722543 0.75 USP7 (0.50) CYP3A4GAA
SCHEMBL29539431 0.75 USP7 (0.50) CYP3A4GAA
SCHEMBL27353893 0.74 GABRA1 (0.54) CA1CA2LMNASLC6A2HTR2B
SCHEMBL6895630 0.73 PTGS1 (0.52) CA1CA2LMNASLC6A2HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004035654-A1 METHOD FOR SEPARATING RESIDUAL MONOMERS AND OLIGOMER FROM POLYCARBONATE BAYER MATERIALSCIENCE AG (DE) 2004-04-29 WO disclosed