SCHEMBL792849

SCHEMBL792849

Cc1ccc2c(C3CCCCC3)c3n(c2c1)CCOc1cc(OC2CCCN(S(C)(=O)=O)C2)ccc1-3

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 6/20 0.35
PIK3CA P42336 6/20 0.35
PRMT5 O14744 5/20 0.34
WDR77 Q9BQA1 5/20 0.34
PRKCA P17252 1/20 0.33
MMP12 P39900 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE4B Q07343 1/20 0.33
IDO1 P14902 1/20 0.32

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
SCHEMBL792853 0.90 PRMT5 (0.38) PIK3CDPIK3CAPRMT5WDR77PRKCA
SCHEMBL772620 0.89 PRKCA (0.46) PIK3CDPIK3CAPRMT5WDR77PRKCA
SCHEMBL771886 0.88 NR1I2 (0.39) PRKCAMMP12GAASMN1; SMN2
SCHEMBL792656 0.82 PRMT5 (0.39) PIK3CDPIK3CAPRMT5WDR77PRKCA
SCHEMBL792848 0.82 ROCK1 (0.42) PRKCAMMP12
SCHEMBL14572897 0.81 NR1I2 (0.37) PIK3CAPRKCAMMP12SMN1; SMN2
SCHEMBL771540 0.75 PRKCA (0.46) PIK3CDPIK3CAPRMT5WDR77PRKCA
SCHEMBL792695 0.75 PRKCA (0.39) PIK3CDPIK3CAPRKCAMMP12
SCHEMBL792437 0.75 PRKCA (0.47) PIK3CDPIK3CAPRKCAMMP12
SCHEMBL792506 0.75 MAOB (0.47) PRKCAMMP12SMN1; SMN2

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 PIK3CD 1700/4885PIK3CA 1586/4885PRMT5 1658/4885

“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.