SCHEMBL792435

SCHEMBL792435

Cc1ccc2c(C3CCCCC3)c3n(c2c1)CCCN(CCN1CCCCC1)c1cc(Cl)ccc1-3

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34
SCN9A Q15858 1/20 0.33
KCNH2 Q12809 1/20 0.33
CACNB4 O00305 1/20 0.33
CACNA1A O00555 1/20 0.33
CACNA1G O43497 1/20 0.33
CACNG3 O60359 1/20 0.33
CACNA1F O60840 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNB3 P54284 1/20 0.33
CACNA2D1 P54289 1/20 0.33
CACNG7 P62955 1/20 0.33
CACNA1B Q00975 1/20 0.33
CACNA1D Q01668 1/20 0.33
CACNB1 Q02641 1/20 0.33
CACNG1 Q06432 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
SCHEMBL792442 0.95 OPRM1 (0.34) LMNAOPRM1OPRD1OPRK1OPRL1
SCHEMBL804901 0.86 PRKCA (0.43) SCN9AKCNH2CACNA1GHTR7
SCHEMBL12510266 0.86 SCN9A (0.32) LMNASCN9AKCNH2CACNA1C
SCHEMBL14572861 0.85 USP14 (0.42) SCN9AKCNH2
SCHEMBL792804 0.85 KCNH2 (0.33) SCN9AKCNH2HTR7
SCHEMBL10283202 0.84 PRKCA (0.45) SCN9AKCNH2CACNA1G
SCHEMBL792440 0.83 DRD2 (0.38) KCNH2SIGMAR1
SCHEMBL792253 0.82 MAPT (0.34) LMNASCN9A
SCHEMBL804085 0.81 PRKCA (0.43) SCN9AKCNH2CACNA1GHTR7
SCHEMBL12427893 0.81 PRKCA (0.43) SCN9AKCNH2CACNA1GHTR7

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 LMNA 4323/4885OPRM1 3434/4885OPRD1 3789/4885

“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.