SCHEMBL10144865

SCHEMBL10144865

C(#Cc1ccc2cc(-c3cnc(C4CCCN4)[nH]3)cnc2c1)c1ccc(-c2cnc([C@@H]3CCCN3)[nH]2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 3/20 0.35
SCN10A Q9Y5Y9 2/20 0.34
NR1H4 Q96RI1 2/20 0.34
MAPK13 O15264 1/20 0.34
MAPK12 P53778 1/20 0.34
MAPK11 Q15759 1/20 0.34
MAPK14 Q16539 1/20 0.34
SSTR3 P32745 2/20 0.33
KCNH2 Q12809 2/20 0.32
SCN3A Q9NY46 2/20 0.31
PYGL P06737 2/20 0.31
SCN9A Q15858 1/20 0.31
PDGFRB P09619 1/20 0.30
PDGFRA P16234 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 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
SCHEMBL15373033 1.00 HPGDS (0.35) HPGDSSCN10ANR1H4MAPK13MAPK12
SCHEMBL10177451 0.88 HPGDS (0.38) HPGDSSCN10ANR1H4MAPK13MAPK12
SCHEMBL882760 0.87 MAPK13 (0.41) HPGDSSCN10AMAPK13MAPK12MAPK11
SCHEMBL933682 0.84 HPGDS (0.37) HPGDSSCN10ANR1H4MAPK13MAPK12
SCHEMBL16572630 0.83 SCN10A (0.51) SCN10AMAPK13MAPK12MAPK11MAPK14
SCHEMBL10144768 0.83 SCN10A (0.51) SCN10AMAPK13MAPK12MAPK11MAPK14
SCHEMBL16405116 0.83 SCN10A (0.51) SCN10AMAPK13MAPK12MAPK11MAPK14
SCHEMBL9980576 0.83 MAPK13 (0.41) HPGDSSCN10ANR1H4MAPK13MAPK12
SCHEMBL10236922 0.81 SCN10A (0.38) SCN10AMAPK13MAPK12MAPK11MAPK14
SCHEMBL1359964 0.81 MAPK13 (0.40) HPGDSSCN10AMAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150038501-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. 2015-02-05 US disclosed
US-8865756-B2 Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2014-10-21 US disclosed
US-20130296311-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2013-11-07 US disclosed
US-20120115855-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2012-05-10 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-20130296311-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 HPGDS 2085/4885SCN10A 3547/4885NR1H4 333/4885
US-20150038501-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 HPGDS 2085/4885SCN10A 3547/4885NR1H4 333/4885
US-20120115855-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 HPGDS 2085/4885SCN10A 3547/4885NR1H4 333/4885

“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.