SCHEMBL11320580

SCHEMBL11320580

COC(=O)NN(C(=O)N1CCC[C@H]1Cc1ccc2cc(-c3ccc4[nH]c([C@@H]5CCCN5C(=O)[C@H](C)c5ccccc5)nc4c3)ccc2c1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRCP P42785 4/20 0.42
KCNH2 Q12809 1/20 0.39
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL11320636 0.97 PRCP (0.41) PRCPKCNH2
SCHEMBL11319371 0.87 PRCP (0.45) PRCPKCNH2
SCHEMBL10123964 0.84 PRCP (0.51) PRCP
SCHEMBL11317687 0.83 PRCP (0.42) PRCP
SCHEMBL12903304 0.81 PRCP (0.37) PRCP
SCHEMBL12903293 0.79 PRCP (0.42) PRCP
SCHEMBL12247797 0.78 KCNH2 (0.51) PRCPKCNH2CYP3A4CYP2C9
SCHEMBL12247799 0.76 PRCP (0.50) PRCPCYP3A4CYP2C9
SCHEMBL10121395 0.76 CYP3A4 (0.52) PRCPKCNH2CYP3A4CYP2C9
SCHEMBL10121311 0.76 PRCP (0.53) PRCP

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-8221737-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2012-07-17 US disclosed
US-20100316607-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2010-12-16 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-20100316607-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 PRCP 275/4885KCNH2 3887/4885CYP3A4 204/4885

“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.