SCHEMBL12295698

SCHEMBL12295698

CC(C)(C)OC(=O)N1CCC[C@H]1c1nc(-c2ccc(Oc3cccc(-c4c[nH]c([C@@H]5CCCN5C(=O)OC(C)(C)C)n4)c3)cc2)c[nH]1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 7/20 0.43
UCHL1 P09936 2/20 0.41
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
GCK P35557 2/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
CHEK2 O96017 1/20 0.38
SCD5 Q86SK9 1/20 0.38
BTK Q06187 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 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
SCHEMBL883236 0.93 HTT (0.42) USP30UCHL1HTTMAPTNPSR1
SCHEMBL564388 0.92 PRCP (0.49) HCRTR1HCRTR2
SCHEMBL564389 0.92 PRCP (0.49) HCRTR1HCRTR2
SCHEMBL10039588 0.92 PRCP (0.49) HCRTR1HCRTR2
SCHEMBL564390 0.92 PRCP (0.49) HCRTR1HCRTR2
SCHEMBL564194 0.91 PRCP (0.48) HCRTR1HCRTR2
SCHEMBL203497 0.91 PRCP (0.48) HCRTR1HCRTR2
SCHEMBL564193 0.91 PRCP (0.48) HCRTR1HCRTR2
SCHEMBL21065074 0.91 USP30 (0.52) USP30UCHL1HCRTR1HCRTR2SCD5
SCHEMBL21065072 0.91 USP30 (0.52) USP30UCHL1HCRTR1HCRTR2SCD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796466-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-05 US disclosed
US-20110237636-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-09-29 US disclosed
US-20110237636-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-09-29 US disclosed
US-20110077280-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-03-31 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 (2 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-20110237636-A1 Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS USP30 2018/4885UCHL1 2118/4885HCRTR1 4503/4885
US-20110077280-A1 Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS USP30 2018/4885UCHL1 2118/4885HCRTR1 4503/4885

“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.