SCHEMBL2756253

SCHEMBL2756253

CC(C)(C)OC(=O)N1CCC[C@H]1c1nc2cc(B3OC(C)(C)C(C)(C)O3)ccc2n1COCC[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.38
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
TP53 P04637 3/20 0.34
MAPT P10636 3/20 0.34
TSHR P16473 5/20 0.34
ALDH1A1 P00352 4/20 0.34
LMNA P02545 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL12016817 1.00 USP30 (0.38) USP30PRMT5WDR77TP53MAPT
SCHEMBL1985511 0.94 USP30 (0.38) USP30PRMT5WDR77TP53MAPT
SCHEMBL1985509 0.94 USP30 (0.38) USP30PRMT5WDR77TP53MAPT
SCHEMBL20401804 0.89 USP30 (0.33) USP30TP53
SCHEMBL2756337 0.88 USP30 (0.32) USP30
SCHEMBL236869 0.85 KMT2A (0.41) USP30TP53MAPTTSHRALDH1A1
SCHEMBL10201136 0.85 TP53 (0.38) TP53MAPTTSHRALDH1A1LMNA
SCHEMBL2756470 0.85 TP53 (0.38) TP53MAPTTSHRALDH1A1LMNA
SCHEMBL236868 0.85 KMT2A (0.41) USP30TP53MAPTTSHRALDH1A1
SCHEMBL1294080 0.85 USP30 (0.36) USP30PRMT5WDR77TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US disclosed
US-9394279-B2 Anti-viral compounds ABBVIE INC. (US) 2016-07-19 US disclosed
US-20150218194-A1 Anti-Viral Compounds ABBVIE INC. (US) 2015-08-06 US 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
US-9006387-B2 Anti-viral compounds ABBVIE INC. (US) 2015-04-14 US disclosed
US-20150087618-A1 Anti-Viral Compounds ABBVIE INC. (US) 2015-03-26 US disclosed
US-8937150-B2 Anti-viral compounds ABBVIE INC. (US) 2015-01-20 US disclosed
US-8937150-B2 Anti-viral compounds ABBVIE INC. (US) 2015-01-20 US disclosed
US-8921514-B2 Anti-viral compounds ABBVIE INC. (US) 2014-12-30 US disclosed
US-20140315792-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES 2014-10-23 US disclosed
US-20140315792-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES 2014-10-23 US disclosed
US-20120172290-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2012-07-05 US disclosed
US-20120004196-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2012-01-05 US disclosed
US-20110092415-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2011-04-21 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 (6 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-20140315792-A1 ANTI-VIRAL COMPOUNDS HAVCR2, EIF2AK2, MAVS USP30 1963/4885PRMT5 2587/4885WDR77 2462/4885
US-20110092415-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS USP30 1963/4885PRMT5 2587/4885WDR77 2462/4885
US-20150087618-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS USP30 1963/4885PRMT5 2587/4885WDR77 2462/4885
US-20150218194-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS USP30 1963/4885PRMT5 2587/4885WDR77 2462/4885
US-20120004196-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS USP30 1963/4885PRMT5 2587/4885WDR77 2462/4885
US-20120172290-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS USP30 1963/4885PRMT5 2587/4885WDR77 2462/4885

“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.