SCHEMBL4496153

SCHEMBL4496153

NC(=O)c1ccc(-c2ccc(N3CCCN(C4CC4)CC3)nn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.45
NPC1 O15118 6/20 0.44
RAB9A P51151 5/20 0.44
TP53 P04637 2/20 0.44
MAPT P10636 2/20 0.44
POLB P06746 1/20 0.44
SCD O00767 3/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
PPARG P37231 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
NCOR2 Q9Y618 1/20 0.40

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
SCHEMBL3043622 0.95 HRH3 (0.48) HRH3NPC1RAB9ATP53MAPT
SCHEMBL4496162 0.84 NPC1 (0.41) HRH3NPC1RAB9ATP53MAPT
SCHEMBL3031402 0.83 NPC1 (0.47) HRH3NPC1RAB9ATP53SCD
SCHEMBL1744217 0.82 SCD (0.54) HRH3NPC1RAB9ATP53MAPT
SCHEMBL1742397 0.81 NPC1 (0.57) HRH3NPC1RAB9ATP53MAPT
SCHEMBL1744595 0.81 NPC1 (0.56) NPC1RAB9ATP53MAPTPOLB
SCHEMBL1743326 0.79 NPC1 (0.44) HRH3NPC1RAB9ATP53MAPT
SCHEMBL1744201 0.79 HRH3 (0.56) HRH3POLBMEN1KMT2AACACB
SCHEMBL13648900 0.76 NPC1 (0.56) HRH3NPC1RAB9ATP53MAPT
SCHEMBL1743158 0.76 NPC1 (0.58) NPC1RAB9ATP53MAPTPOLB

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-8846677-B2 Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2014-09-30 US disclosed
US-8501739-B2 Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2013-08-06 US disclosed
US-20120232078-A1 Novel Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2012-09-13 US disclosed
US-20090312309-A1 Novel Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2009-12-17 US disclosed
EP-1902028-A2 HISTAMINE H3 RECEPTOR ANTAGONISTS Novo Nordisk A/S (DK) 2008-03-26 EP disclosed
WO-2007003604-A2 HISTS1MINE H3 RECEPTOR ANTAGONISTS NOVO NORDISK A/S (DK) 2007-01-11 WO 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 (2 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-20120232078-A1 Novel Medicaments HRH3, HRH4, HRH1 HRH3 1/4885NPC1 2646/4885RAB9A 4607/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 HRH3 1/4885NPC1 2646/4885RAB9A 4607/4885

“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.