SCHEMBL792515

SCHEMBL792515

Cc1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)O)Oc1ccccc1-3

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.52
MMP12 P39900 1/20 0.52
NR1I2 O75469 1/20 0.36
SCN9A Q15858 2/20 0.34
CYP2C9 P11712 2/20 0.34
HPGD P15428 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL792358 0.91 PRKCA (0.52) PRKCAMMP12NR1I2SCN9ACYP2C9
SCHEMBL792760 0.89 PRKCA (0.48) PRKCAMMP12HPGDKMT2APOLB
SCHEMBL394639 0.88 PRKCA (0.63) PRKCAMMP12NR1I2SCN9ACYP2C9
SCHEMBL14572875 0.86 PRKCA (0.49) PRKCAMMP12NR1I2CYP2C9HPGD
SCHEMBL392730 0.86 PRKCA (0.55) PRKCAMMP12NR1I2SCN9ACYP2C9
SCHEMBL803941 0.84 PRKCA (0.49) PRKCAMMP12NR1I2SCN9ACYP2C9
SCHEMBL772023 0.83 PRKCA (0.65) PRKCAMMP12NR1I2SCN9ACYP2C9
SCHEMBL792723 0.80 PRKCA (0.49) PRKCAMMP12NR1I2SCN9A
SCHEMBL393719 0.79 PRKCA (0.52) PRKCAMMP12NR1I2SCN9ACYP3A4
SCHEMBL771191 0.79 PRKCA (0.54) PRKCAMMP12NR1I2SCN9ACYP2C9

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 PRKCA 2404/4885MMP12 1013/4885NR1I2 1189/4885

“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.