SCHEMBL30825751

SCHEMBL30825751

COc1ccc(C2(O)c3ccccc3Oc3ccccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.46
SCN9A Q15858 2/20 0.42
SLC6A3 Q01959 2/20 0.40
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
ATM Q13315 1/20 0.39
OPRM1 P35372 2/20 0.39
OPRL1 P41146 2/20 0.39
P2RX4 Q99571 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
PDK2 Q15119 3/20 0.38
TRPA1 O75762 1/20 0.38
CA4 P22748 1/20 0.38
LTA4H P09960 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL5583991 1.00 CHRM3 (0.46) CHRM3SCN9ASLC6A3GABRA1GABRB2
SCHEMBL9700918 0.86 CHRM3 (0.41) CHRM3P2RX4PDK2LTA4HKMT2A
SCHEMBL5584000 0.81 ATM (0.40) SLC6A3GABRA1GABRB2ATMOPRM1
SCHEMBL7322612 0.81 CHRM3 (0.45) CHRM3SLC6A3OPRM1OPRL1P2RX4
SCHEMBL7315127 0.81 PDK2 (0.51) SCN9ASLC6A3GABRA1GABRB2ATM
SCHEMBL22048471 0.80 CHRM3 (0.44) CHRM3P2RX4SLC6A2PDK2KMT2A
SCHEMBL9407348 0.80 ATM (0.39) SCN9ASLC6A3GABRA1GABRB2ATM
SCHEMBL30886749 0.80 OPRM1 (0.42) SLC6A3GABRA1GABRB2ATMOPRM1
SCHEMBL29722 0.80 CHRM3 (0.46) CHRM3SCN9AP2RX4KMT2AMEN1
SCHEMBL7317413 0.77 CHRM3 (0.42) CHRM3SCN9ASLC6A3ATMOPRM1

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-117625105-A Epoxy resin adhesive and preparation method and application thereof 韦尔通科技股份有限公司 2024-03-01 CN claimed