SCHEMBL6904036

SCHEMBL6904036

COc1cc2c(cc1OC)Cc1cc(OC)c(OC)cc1CC2

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.84
CYP3A4 P08684 1/20 0.84
DRD1 P21728 2/20 0.58
DRD4 P21917 2/20 0.58
DRD5 P21918 2/20 0.58
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
KDM4E B2RXH2 5/20 0.52
MAOA P21397 5/20 0.52
CHRNA7 P36544 2/20 0.52
MAOB P27338 2/20 0.52
SLC6A4 P31645 1/20 0.52
DRD2 P14416 1/20 0.51
DRD3 P35462 1/20 0.51
PDE4D Q08499 1/20 0.46
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
CA7 P43166 1/20 0.44
ALDH1A1 P00352 3/20 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
SCHEMBL13456132 1.00 MAPT (0.84) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL2594537 0.92 MAPT (0.68) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL29924708 0.92 MAPT (0.68) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL14481557 0.92 MAPT (0.68) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL4571013 0.92 CYP3A4 (1.00) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL2138785 0.92 CYP3A4 (1.00) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL22953335 0.92 CYP3A4 (1.00) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL29394312 0.92 CYP3A4 (1.00) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL2241521 0.84 GAA (0.61) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL59900 0.81 MAPT (0.62) MAPTCYP3A4DRD1DRD4DRD5

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed