SCHEMBL7602060

SCHEMBL7602060

CC1(C)OB(c2ccc3cc(-c4cnc([C@H]5CCCOC5)[nH]4)ccc3c2)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPL P06858 4/20 0.40
LIPG Q9Y5X9 4/20 0.40
SCN10A Q9Y5Y9 1/20 0.34
PYGL P06737 2/20 0.34
HIF1A Q16665 1/20 0.33
DGAT1 O75907 1/20 0.33
HPGDS O60760 1/20 0.32
SSTR3 P32745 3/20 0.31
SNCA P37840 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
MAPK8 P45983 1/20 0.30
MAPK9 P45984 1/20 0.30
MAPK10 P53779 1/20 0.30
KCNH2 Q12809 2/20 0.30
BRAF P15056 1/20 0.30

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
SCHEMBL7600335 0.90 LPL (0.44) LPLLIPGSCN10APYGLHIF1A
SCHEMBL7605047 0.80 SCN10A (0.38) SCN10APYGLHPGDSMAPK8MAPK9
SCHEMBL6126994 0.80 LPL (0.41) LPLLIPGSCN10APYGLDGAT1
SCHEMBL6126990 0.80 LPL (0.41) LPLLIPGSCN10APYGLDGAT1
SCHEMBL7605241 0.80 LPL (0.42) LPLLIPGSCN10AHIF1ADGAT1
SCHEMBL17014415 0.79 LPL (0.41) LPLLIPGSCN10AHIF1ADGAT1
SCHEMBL16921672 0.78 LPL (0.40) LPLLIPGPYGLIRAK4KCNH2
SCHEMBL15274593 0.78 LPL (0.40) LPLLIPGPYGLIRAK4KCNH2
SCHEMBL469988 0.77 LPL (0.44) LPLLIPGSCN10ADGAT1HPGDS
SCHEMBL15397708 0.77 LPL (0.40) LPLLIPGPYGLDGAT1SNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150057218-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS INC (US) 2015-02-26 US disclosed
US-8921369-B2 Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2014-12-30 US disclosed
US-8877707-B2 Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2014-11-04 US disclosed
US-20130203656-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2013-08-08 US disclosed
US-20130096101-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2013-04-18 US disclosed
US-20120122864-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2012-05-17 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 (4 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-20130096101-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 LPL 437/4885LIPG 1416/4885SCN10A 3491/4885
US-20120122864-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 LPL 458/4885LIPG 1401/4885SCN10A 3547/4885
US-20150057218-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 LPL 458/4885LIPG 1401/4885SCN10A 3547/4885
US-20130203656-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 LPL 458/4885LIPG 1401/4885SCN10A 3547/4885

“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.