SCHEMBL13772010

SCHEMBL13772010

COc1ccc2cc(C)ccc2c1-c1c(OC)ccc2cc(C)ccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
ACHE P22303 2/20 0.54
CYP2A6 P11509 3/20 0.52
CYP1A2 P05177 3/20 0.52
ALDH1A1 P00352 3/20 0.48
CYP3A4 P08684 1/20 0.48
LMNA P02545 3/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NQO1 P15559 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
HIF1A Q16665 1/20 0.44
EPAS1 Q99814 1/20 0.44
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL29350013 1.00 MAPT (0.57) MAPTACHECYP2A6CYP1A2ALDH1A1
SCHEMBL806517 0.84 ACHE (0.54) MAPTACHECYP2A6CYP1A2ALDH1A1
SCHEMBL23060973 0.81 ALDH1A1 (0.47) MAPTACHEALDH1A1CYP3A4LMNA
SCHEMBL25666398 0.81 PLAU (0.57) MAPTACHECYP1A2ALDH1A1LMNA
SCHEMBL13199297 0.81 ACHE (0.50) MAPTACHECYP2A6CYP1A2ALDH1A1
SCHEMBL806512 0.81 CYP19A1 (0.52) MAPTACHECYP2A6CYP1A2ALDH1A1
SCHEMBL14279013 0.81 CYP19A1 (0.52) MAPTACHECYP2A6CYP1A2ALDH1A1
SCHEMBL28754763 0.80 MAOB (0.44) MAPTACHECYP1A2ALDH1A1CYP3A4
SCHEMBL3361877 0.79 ACHE (0.62) MAPTACHECYP2A6CYP1A2ALDH1A1
SCHEMBL3829305 0.78 MAPT (0.55) MAPTCYP2A6ALDH1A1LMNAKDM4E

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-20090189519-A1 Organic electroluminescent compounds and light emitting diode using the same GRACEL DISPLAY INC. (KR) 2009-07-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090189519-A1 Organic electroluminescent compounds and light emitting diode using the same OCIAD1, AOX1, OCIAD2 MAPT 906/4885ACHE 947/4885CYP2A6 1293/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.