SCHEMBL10202467

SCHEMBL10202467

CC(C)(C)OC(=O)N1CCC[C@H]1c1nc2cc(C#Cc3cccc(-c4nc[nH]c4[C@@H]4CCCN4C(=O)OC(C)(C)C)c3)ccc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 16/20 0.40
HCRTR2 O43614 16/20 0.40
PRCP P42785 2/20 0.38
PTGES O14684 2/20 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
SCHEMBL15893390 0.94 HCRTR1 (0.44) HCRTR1HCRTR2
SCHEMBL10202465 0.93 CHEK2 (0.39) HCRTR1HCRTR2PRCPPTGES
SCHEMBL12403399 0.90 HCRTR1 (0.42) HCRTR1HCRTR2PRCPPTGES
SCHEMBL19488287 0.89 GRM5 (0.34) HCRTR1HCRTR2PRCP
SCHEMBL12406118 0.86 PRCP (0.42) HCRTR1HCRTR2PRCP
SCHEMBL12798471 0.85 HCRTR1 (0.44) HCRTR1HCRTR2PRCPPTGES
SCHEMBL15048040 0.83 CHEK2 (0.42) HCRTR1HCRTR2PRCPPTGES
SCHEMBL11924830 0.82 HCRTR1 (0.42) HCRTR1HCRTR2PRCPPTGES
SCHEMBL2708020 0.82 HCRTR1 (0.46) HCRTR1HCRTR2
SCHEMBL18462503 0.82 HCRTR1 (0.46) HCRTR1HCRTR2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2601188-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-10-18 EP disclosed
US-8809548-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-19 US disclosed
US-8809548-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-19 US disclosed
WO-2012018325-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-02-09 WO disclosed
WO-2010096302-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-26 WO disclosed
US-20100215616-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2010-08-26 US disclosed
US-20100215616-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2010-08-26 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-20100215616-A1 Hepatitis C Virus Inhibitors HAVCR2, PYGL, HCCS HCRTR1 4453/4885HCRTR2 4639/4885PRCP 190/4885

“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.