SCHEMBL774557

SCHEMBL774557

O=C(O)c1ccc(CNC(=O)c2ccc3c(C4CCCCC4)c4n(c3c2)CCOc2ccccc2-4)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.54
MMP12 P39900 1/20 0.54
SCN9A Q15858 1/20 0.44
PTGER4 P35408 1/20 0.43
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
NR1I2 O75469 1/20 0.42
NR1H4 Q96RI1 3/20 0.40
LMNA P02545 3/20 0.40
TP53 P04637 1/20 0.40
EPHX2 P34913 2/20 0.40
TBXA2R P21731 1/20 0.39
HTR4 Q13639 1/20 0.39
ALDH1A1 P00352 3/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OGFRL1 Q5TC84 1/20 0.38
RORC P51449 1/20 0.38

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
SCHEMBL2198748 0.93 PRKCA (0.54) PRKCAMMP12SCN9AHSD17B10HPGD
SCHEMBL773199 0.90 PRKCA (0.49) PRKCAMMP12SCN9APTGER4NR1I2
SCHEMBL773448 0.89 PRKCA (0.54) PRKCAMMP12SCN9AHSD17B10HPGD
SCHEMBL774547 0.88 PRKCA (0.53) PRKCAMMP12SCN9ANR1I2KDM4E
SCHEMBL30486080 0.88 PRKCA (0.64) PRKCAMMP12SCN9ARAB9ANR1I2
SCHEMBL772828 0.88 PRKCA (0.64) PRKCAMMP12SCN9ARAB9ANR1I2
SCHEMBL772113 0.87 PRKCA (0.55) PRKCAMMP12SCN9AHPGDRAB9A
SCHEMBL773352 0.87 PRKCA (0.53) PRKCAMMP12SCN9ANR1I2HTR4
SCHEMBL773025 0.87 PRKCA (0.53) PRKCAMMP12SCN9ANR1I2
SCHEMBL773063 0.85 PRKCA (0.48) PRKCAMMP12SCN9ARAB9ANR1I2

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 9 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-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
EP-2206715-A1 Fused heterotetracyclic compounds and use thereof as hcv polymerase inhibitor Japan Tobacco, Inc. (JP) 2010-07-14 EP disclosed
EP-1719773-B1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC (JP) 2009-04-15 EP disclosed
US-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2007-03-01 US disclosed
EP-1719773-A1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR Japan Tobacco, Inc. (JP) 2006-11-08 EP 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.