SCHEMBL11210002

SCHEMBL11210002

C1=C2OC2(c2ccccc2)Oc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
UBE2N P61088 1/20 0.45
KMT2A Q03164 1/20 0.45
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
CNR1 P21554 4/20 0.31
NPSR1 Q6W5P4 2/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL7442888 0.74 CNR1 (0.44) MEN1TP53MAPTTSHRMAPK1
SCHEMBL30307890 0.74 CNR1 (0.44) MEN1TP53MAPTTSHRMAPK1
SCHEMBL8684877 0.71 MEN1 (0.46) MEN1TP53MAPTTSHRMAPK1
SCHEMBL8680342 0.69 TSHR (0.53) MEN1TP53MAPTTSHRMAPK1
SCHEMBL8679953 0.65 TSHR (0.62) MEN1TP53MAPTTSHRMAPK1
SCHEMBL8681146 0.65 MEN1 (0.62) MEN1TP53MAPTTSHRMAPK1
SCHEMBL10751360 0.65 MEN1 (0.37) MEN1TP53MAPTTSHRMAPK1
SCHEMBL8871056 0.63 HTR2C (0.46) MEN1TP53MAPTTSHRMAPK1
SCHEMBL9488195 0.61 OPRM1 (0.36) TSHR
SCHEMBL1698175 0.61 CA1 (0.37)

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
US-4334067-A ANTICONVULASANTS, ANTIULCER AGENTS MARUKO SEIYAKU CO., LTD. (JP) 1982-06-08 US disclosed