SCHEMBL4412083

SCHEMBL4412083

CNC1CN(c2cc(COCc3cccc(C(=O)OC)c3)nc(N)n2)C1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.52
HRH4 Q9H3N8 10/20 0.49
ADCY10 Q96PN6 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.41
MPO P05164 1/20 0.41
TLR8 Q9NR97 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
CD74 P04233 1/20 0.40
MIF P14174 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
SCHEMBL604404 0.92 HRH3 (0.53) HRH3HRH4MRGPRX4
SCHEMBL603237 0.92 HRH3 (0.53) HRH3HRH4
SCHEMBL605017 0.90 HRH3 (0.55) HRH3HRH4
SCHEMBL20472944 0.87 HRH3 (0.52) HRH3HRH4ADCY10LOXL2MPO
SCHEMBL605322 0.85 HRH3 (0.57) HRH3HRH4
SCHEMBL603974 0.85 HRH3 (0.48) HRH3HRH4TLR8TLR7MRGPRX4
SCHEMBL605526 0.82 HRH3 (0.53) HRH3HRH4
SCHEMBL605523 0.82 HRH3 (0.53) HRH3HRH4
SCHEMBL16822318 0.82 HRH3 (0.53) HRH3HRH4ADCY10TLR8TLR7
SCHEMBL603256 0.80 HRH3 (0.60) HRH3HRH4

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-9688989-B2 H4 receptor inhibitors for treating tinnitus SENSORION (FR) 2017-06-27 US disclosed
US-9526725-B2 Selective histamine H4 receptor antagonists for the treatment of vestibular disorders INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2016-12-27 US disclosed
US-20150176010-A1 H4 RECEPTOR INHIBITORS FOR TREATING TINNITUS SENSORION (FR) 2015-06-25 US disclosed
WO-2009077608-A1 2 -AMINOPYRIMIDINE DERIVATIVES AS HISTAMINE H4 ANTAGONISTS PALAU PHARMA, S. A. (ES) 2009-06-25 WO disclosed