SCHEMBL604635

SCHEMBL604635

CNC1CN(c2nc(N)nc(-c3ccccc3)c2C)C1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 16/20 0.55
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
HRH3 Q9Y5N1 10/20 0.46
KCNH2 Q12809 5/20 0.46
HRH1 P35367 2/20 0.43
HRH2 P25021 1/20 0.43

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
SCHEMBL606055 0.86 HRH4 (0.54) HRH4ADORA2AADORA1HRH3KCNH2
SCHEMBL1774373 0.77 HRH4 (0.60) HRH4HRH3KCNH2HRH1HRH2
SCHEMBL602330 0.74 HRH4 (0.56) HRH4ADORA2AADORA1HRH3HRH2
SCHEMBL3430563 0.73 HRH4 (0.54) HRH4
SCHEMBL613451 0.73 HRH4 (0.50) HRH4HRH3KCNH2HRH1HRH2
Hydrochloric Acid SCHEMBL605480 0.73 HRH4 (0.56) HRH4ADORA2AADORA1HRH3HRH2
SCHEMBL1774855 0.73 HRH4 (0.52) HRH4HRH3KCNH2HRH1HRH2
SCHEMBL614931 0.73 HRH4 (0.87) HRH4HRH3KCNH2HRH1HRH2
SCHEMBL605428 0.72 HRH4 (0.61) HRH4ADORA2AADORA1HRH3
Hydrochloric Acid SCHEMBL6512235 0.71 HRH3 (0.63) HRH4ADORA2AADORA1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005054239-A1 2-AMINOPYRIMIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2005-06-16 WO claimed
EP-3378476-A1 H4 RECEPTOR INHIBITORS FOR TREATING TINNITUS Sensorion (FR) 2018-09-26 EP disclosed
US-9688989-B2 H4 receptor inhibitors for treating tinnitus SENSORION (FR) 2017-06-27 US disclosed
EP-3130376-A1 SELECTIVE HISTAMINE H4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF VESTIBULAR DISORDERS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2017-02-15 EP 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
EP-2382013-B1 SELECTIVE HISTAMINE H4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF VESTIBULAR DISORDERS. INSERM INST NAT DE LA SANTÉ ET DE LA RECH MÉDICALE (FR) 2016-07-13 EP disclosed
US-20150176010-A1 H4 RECEPTOR INHIBITORS FOR TREATING TINNITUS SENSORION (FR) 2015-06-25 US disclosed
US-20120039913-A1 Selective Histamine H4 Receptor Antagonists for the Treatment of Vestibular Disorders INSERM (institut National de la Sante de la Recher Medicale) (FR) 2012-02-16 US disclosed
EP-2382013-A1 SELECTIVE HISTAMINE H4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF VESTIBULAR DISORDERS. INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2011-11-02 EP disclosed
WO-2010072829-A1 SELECTIVE HISTAMINE H4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF VESTIBULAR DISORDERS. INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2010-07-01 WO disclosed
WO-2005054239-A1 2-AMINOPYRIMIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2005-06-16 WO disclosed