SCHEMBL2367182

SCHEMBL2367182

CC(C)(C)OC(=O)N1CCCC1C(=O)Nc1cc(Br)ccc1N

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
USP30 Q70CQ3 2/20 0.58
NPC1 O15118 2/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.52
ALDH1A1 P00352 1/20 0.49
JAK2 O60674 1/20 0.47
UCHL1 P09936 2/20 0.46
SCN4A P35499 1/20 0.45
AAK1 Q2M2I8 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 3/20 0.43
SCN5A Q14524 1/20 0.43
SCN3A Q9NY46 1/20 0.43
KDM4E B2RXH2 3/20 0.43
RAB9A P51151 1/20 0.43
FPR3 P25089 1/20 0.43
FPR2 P25090 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
SCHEMBL2367183 1.00 LMNA (0.63) LMNANPSR1USP30NPC1MEN1
SCHEMBL12327657 0.97 LMNA (0.59) LMNANPSR1USP30NPC1MEN1
SCHEMBL12098332 0.92 LMNA (0.63) LMNANPSR1USP30NPC1MEN1
SCHEMBL7609243 0.92 LMNA (0.63) LMNANPSR1USP30NPC1MEN1
SCHEMBL38657837 0.92 LMNA (0.63) LMNANPSR1USP30NPC1MEN1
SCHEMBL31315648 0.89 LMNA (0.66) LMNANPSR1USP30NPC1MEN1
SCHEMBL12600537 0.89 LMNA (0.59) LMNANPSR1USP30NPC1MEN1
SCHEMBL38659170 0.88 LMNA (0.64) LMNANPSR1USP30NPC1MEN1
SCHEMBL38656332 0.88 LMNA (0.64) LMNANPSR1USP30NPC1MEN1
SCHEMBL3835665 0.86 LMNA (0.70) LMNANPSR1USP30NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017076201-A1 HCV INHIBITORS, PREPARATION METHOD AND USE THEREOF 江苏豪森药业集团有限公司 2017-05-11 WO disclosed
US-20150218194-A1 Anti-Viral Compounds ABBVIE INC. (US) 2015-08-06 US disclosed
US-9006387-B2 Anti-viral compounds ABBVIE INC. (US) 2015-04-14 US disclosed
EP-2853531-A2 Antiviral compounds AbbVie Bahamas Ltd. (BS) 2015-04-01 EP disclosed
EP-2455376-B1 Heterocyclic compounds as inhibitors of hepatitis C virus (HCV) ABBVIE BAHAMAS LTD (BS) 2014-11-26 EP disclosed
US-20140315792-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES 2014-10-23 US disclosed
EP-2337781-B1 ANTI-VIRAL COMPOUNDS TO TREAT HCV INFECTION ABBVIE BAHAMAS LTD (BS) 2014-07-23 EP disclosed
EP-2368890-B9 Hepatitis C virus inhibitors ABBVIE BAHAMAS LTD (BS) 2013-10-30 EP disclosed
EP-2628481-A1 Trisubstituted heterocycles as replication inhibitors of hepatitis C virus HCV AbbVie Bahamas Ltd. (BS) 2013-08-21 EP disclosed
EP-2368890-B1 Hepatitis C virus inhibitors ABBVIE BAHAMAS LTD (BS) 2013-04-17 EP disclosed
EP-2455376-A1 Heterocyclic compounds as inhibitors of hepatitis C virus (HCV) Abbott Laboratories (US) 2012-05-23 EP disclosed
EP-2368890-A1 Hepatitis C virus inhibitors Abbott Laboratories (US) 2011-09-28 EP disclosed
US-20100317568-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2010-12-16 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 (3 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-20100317568-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LMNA 3118/4885NPSR1 4296/4885USP30 1963/4885
US-20140315792-A1 ANTI-VIRAL COMPOUNDS HAVCR2, EIF2AK2, MAVS LMNA 3118/4885NPSR1 4296/4885USP30 1963/4885
US-20150218194-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LMNA 3118/4885NPSR1 4296/4885USP30 1963/4885

“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.