SCHEMBL27454580

SCHEMBL27454580

Cc1ccc2c(c1)OC(C)(C)C2(C)c1cc(C)c(O)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.34
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
CNR2 P34972 5/20 0.33
CNR1 P21554 4/20 0.33
TRPA1 O75762 2/20 0.33
TRPV1 Q8NER1 2/20 0.33
TRPV3 Q8NET8 2/20 0.33
TRPV4 Q9HBA0 2/20 0.33
TRPV2 Q9Y5S1 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
G6PD P11413 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 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
SCHEMBL24701674 0.71 KDM4E (0.40) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL4631381 0.70 ACHE (0.34) ALOX5PTGS1PTGS2L3MBTL1ACHE
SCHEMBL6838753 0.67 FTO (0.41) ALOX5PTGS1PTGS2CNR2L3MBTL1
SCHEMBL4631356 0.67 AKR1B1 (0.34) ALOX5PTGS1PTGS2CNR2L3MBTL1
SCHEMBL15869808 0.65 KDM4E (0.43) TRPA1ACHEGAAALDH1A1KDM4E
SCHEMBL899618 0.64 ESR1 (0.45) ALOX5PTGS1PTGS2CNR1TRPA1
SCHEMBL13297054 0.62 ALDH1A1 (0.36) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL14252820 0.61 MAPT (0.42) CNR1MEN1GAAKMT2AALDH1A1
SCHEMBL7522231 0.61 FTO (0.53) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL5561285 0.61 CNR2 (0.33) CNR2CNR1TRPA1TRPV1TRPV3

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
CN-1114966-A Fire-resistent polycarbonate resin composition GEN ELECTRIC (US) 1996-01-17 CN disclosed