SCHEMBL12567167

SCHEMBL12567167

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Br)cn1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.58
USP30 Q70CQ3 3/20 0.57
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
UCHL1 P09936 3/20 0.50
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
JAK2 O60674 1/20 0.47
KDM4E B2RXH2 3/20 0.47
POLB P06746 2/20 0.47
SCN4A P35499 1/20 0.46
HDAC8 Q9BY41 1/20 0.44
SCN5A Q14524 1/20 0.43
SCN3A Q9NY46 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL12599788 0.89 NPC1 (0.58) NPC1USP30LMNANPSR1MEN1
SCHEMBL12567215 0.87 USP30 (0.60) NPC1USP30LMNANPSR1MEN1
SCHEMBL31188377 0.87 USP30 (0.60) NPC1USP30LMNANPSR1MEN1
SCHEMBL3834612 0.87 USP30 (0.60) NPC1USP30LMNANPSR1MEN1
SCHEMBL31148025 0.85 NPC1 (0.54) NPC1USP30LMNANPSR1MEN1
SCHEMBL6598593 0.83 USP30 (0.57) NPC1USP30LMNANPSR1MEN1
SCHEMBL16511611 0.83 LMNA (0.58) NPC1USP30LMNANPSR1MEN1
SCHEMBL28869484 0.83 LMNA (0.58) NPC1USP30LMNANPSR1MEN1
SCHEMBL38658094 0.82 L3MBTL1 (0.58) NPC1USP30LMNANPSR1MEN1
SCHEMBL10092397 0.81 NPC1 (0.77) NPC1USP30LMNANPSR1MEN1

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
WO-2011075607-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-06-23 WO disclosed
US-20110152246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-06-23 US disclosed
US-20110152246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-06-23 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-20110152246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, IRF3 NPC1 993/4885USP30 1588/4885LMNA 2659/4885

“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.