SCHEMBL792918

SCHEMBL792918

COc1ccc2c(c1)OCCn1c-2c(C2CCCCC2)c2ccc(OC=O)cc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 4/20 0.36
KCNH2 Q12809 7/20 0.36
PRKCA P17252 1/20 0.36
MMP12 P39900 1/20 0.36
CYP3A4 P08684 2/20 0.35
SCN5A Q14524 2/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 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
SCHEMBL792822 0.89 PRKCA (0.44) NR1I2PRKCAMMP12
SCHEMBL14572897 0.86 NR1I2 (0.37) NR1I2KCNH2PRKCAMMP12CYP3A4
SCHEMBL792769 0.85 MAOB (0.47) PRKCAMMP12
SCHEMBL792719 0.84 DRD1 (0.39) NR1I2PRKCAMMP12CNR2ROCK2
SCHEMBL772000 0.84 PRKCA (0.51) NR1I2KCNH2PRKCAMMP12CYP3A4
SCHEMBL13285999 0.83 PRKCA (0.43) NR1I2KCNH2PRKCAMMP12CYP3A4
SCHEMBL14606930 0.83 PRKCA (0.37) NR1I2KCNH2PRKCAMMP12CYP3A4
SCHEMBL792931 0.81 KCNH2 (0.48) NR1I2KCNH2PRKCAMMP12CYP3A4
SCHEMBL792968 0.80 NR1I2 (0.47) NR1I2KCNH2PRKCAMMP12CYP3A4
SCHEMBL772290 0.79 PRKCA (0.49) NR1I2KCNH2PRKCAMMP12CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 US disclosed
US-7977331-B1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2011-07-12 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-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 NR1I2 1189/4885KCNH2 3813/4885PRKCA 2404/4885

“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.