SCHEMBL888977

SCHEMBL888977

CC(C)(C)OC(=O)N1CCC[C@H]1CNc1ncc(-c2ccc3cc(-c4c[nH]c([C@@H]5CCCN5C(=O)OC(C)(C)C)n4)ccc3c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.43
CHEK2 O96017 1/20 0.40
GPR119 Q8TDV5 2/20 0.39
HCRTR1 O43613 2/20 0.39
HCRTR2 O43614 1/20 0.39
WNT1 P04628 1/20 0.37
GSK3B P49841 1/20 0.37
DYRK1A Q13627 1/20 0.37
ALDH1A1 P00352 2/20 0.37
TRPV1 Q8NER1 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
OPRD1 P41143 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 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
SCHEMBL889077 0.92 PRMT5 (0.49) PRMT5CHEK2GPR119LMNANPSR1
SCHEMBL889122 0.92 PRMT5 (0.48) PRMT5CHEK2GPR119HCRTR1HCRTR2
SCHEMBL888999 0.89 PRMT5 (0.40) PRMT5CHEK2GPR119HCRTR1HCRTR2
SCHEMBL14924575 0.85 ALDH1A1 (0.43) CHEK2ALDH1A1MEN1LMNAMAPT
SCHEMBL12104032 0.85 ALDH1A1 (0.43) CHEK2ALDH1A1MEN1LMNAMAPT
SCHEMBL12810036 0.85 PRMT5 (0.37) PRMT5CHEK2GPR119HCRTR1HCRTR2
SCHEMBL889126 0.85 CYP3A4 (0.35) CHEK2WNT1GSK3BDYRK1AALDH1A1
SCHEMBL888912 0.85 CYP3A4 (0.35) CHEK2WNT1GSK3BDYRK1AALDH1A1
SCHEMBL889123 0.84 CYP3A4 (0.40) HCRTR1HCRTR2WNT1GSK3BDYRK1A
SCHEMBL12810166 0.84 L3MBTL1 (0.48) PRMT5CHEK2GPR119HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759332-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-06-24 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 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-20110064697-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 PRMT5 1634/4885CHEK2 4338/4885GPR119 2170/4885

“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.