SCHEMBL772468

SCHEMBL772468

CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CCOc1ccccc1-3

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.46
MMP12 P39900 1/20 0.46
SCN9A Q15858 3/20 0.41
NR1I2 O75469 1/20 0.40
MMP1 P03956 3/20 0.37
CENPE Q02224 1/20 0.36
CTSL P07711 3/20 0.36
ACE P12821 1/20 0.36
WDR5 P61964 1/20 0.35
KMT2A Q03164 1/20 0.35
LNPEP Q9UIQ6 1/20 0.34
TSHR P16473 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL774159 0.92 PRKCA (0.47) PRKCAMMP12SCN9ANR1I2ACE
SCHEMBL772404 0.92 PRKCA (0.47) PRKCAMMP12SCN9ANR1I2ACE
SCHEMBL771670 0.91 PRKCA (0.46) PRKCAMMP12SCN9ANR1I2LNPEP
SCHEMBL774189 0.91 PRKCA (0.46) PRKCAMMP12SCN9ANR1I2LNPEP
SCHEMBL774956 0.91 PRKCA (0.45) PRKCAMMP12SCN9ANR1I2ACE
SCHEMBL772772 0.90 KCNH2 (0.41) SCN9ANR1I2MMP1CTSL
SCHEMBL774250 0.88 PRKCA (0.46) PRKCAMMP12SCN9ANR1I2HDAC1
SCHEMBL772014 0.87 PRKCA (0.49) PRKCAMMP12SCN9ANR1I2CTSL
SCHEMBL14606826 0.86 PRKCA (0.41) PRKCAMMP12SCN9ANR1I2CTSL
SCHEMBL773806 0.85 PRKCA (0.45) PRKCAMMP12SCN9ANR1I2

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 5 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
US-7977331-B1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2011-07-12 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
US-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2007-03-01 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 (2 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-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor POLI, TERT, ZC3HAV1 PRKCA 2404/4885MMP12 1013/4885SCN9A 3087/4885
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 PRKCA 2404/4885MMP12 1013/4885SCN9A 3087/4885

“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.