SCHEMBL3057210

SCHEMBL3057210

Cc1ccc(-c2ncc(-c3ccc4[nH]c([C@@H]5CCCN5C(=O)[C@@H](c5ccccc5)N(C)C)nc4c3)o2)cc1NC(=O)[C@@H]1CCCN1C(=O)[C@@H](c1ccccc1)N(C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRCP P42785 4/20 0.37
KCNH2 Q12809 1/20 0.36
HCRTR1 O43613 3/20 0.36
HCRTR2 O43614 3/20 0.36

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
SCHEMBL3047481 1.00 PRCP (0.37) PRCPKCNH2HCRTR1HCRTR2
SCHEMBL15948174 0.94 KCNH2 (0.38) PRCPKCNH2HCRTR1HCRTR2
SCHEMBL2279257 0.94 KCNH2 (0.38) PRCPKCNH2HCRTR1HCRTR2
SCHEMBL3055605 0.93 KCNH2 (0.45) PRCPKCNH2
SCHEMBL3054614 0.93 KCNH2 (0.45) PRCPKCNH2
SCHEMBL10202398 0.93 LMNA (0.44) PRCPKCNH2HCRTR1HCRTR2
SCHEMBL2276860 0.92 HCRTR1 (0.39) PRCPKCNH2HCRTR1HCRTR2
SCHEMBL2276865 0.92 HCRTR1 (0.39) PRCPKCNH2HCRTR1HCRTR2
SCHEMBL12404476 0.92 KCNH2 (0.45) PRCPKCNH2
SCHEMBL3055832 0.92 HCRTR1 (0.37) PRCPKCNH2HCRTR1HCRTR2

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
EP-2398794-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2013-01-16 EP claimed
US-20100215616-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2010-08-26 US claimed

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-20100215616-A1 Hepatitis C Virus Inhibitors HAVCR2, PYGL, HCCS PRCP 190/4885KCNH2 4523/4885HCRTR1 4453/4885

“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.