SCHEMBL603047

SCHEMBL603047

CN1[C@@H]2CC[C@H]1CC(Nc1nc(N)nc3c1CCCc1ccccc1-3)C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 6/20 0.53
▸ HRH3 Q9Y5N1 2/20 0.43
▸ HRH1 P35367 2/20 0.43
▸ HRH2 P25021 1/20 0.43
▸ BCHE P06276 1/20 0.41
▸ KDR P35968 3/20 0.41
▸ EGFR P00533 3/20 0.41
▸ MAPK14 Q16539 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ BRD4 O60885 1/20 0.37
▸ ATAD2 Q6PL18 1/20 0.37
▸ HTR3E A5X5Y0 1/20 0.37
▸ HTR3B O95264 1/20 0.37
▸ CHRM4 P08173 1/20 0.37
▸ CHRM5 P08912 1/20 0.37
▸ CHRNB2 P17787 1/20 0.37
▸ CHRNB4 P30926 1/20 0.37
▸ CHRNA3 P32297 1/20 0.37
▸ CHRNA7 P36544 1/20 0.37
▸ CHRNA4 P43681 1/20 0.37

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
SCHEMBL14084184 0.86 HRH4 (0.52) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084186 0.83 HRH4 (0.52) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084170 0.82 HRH4 (0.53) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084167 0.81 HRH4 (0.55) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084169 0.81 HRH4 (0.53) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084221 0.80 HRH4 (0.52) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084222 0.80 HRH4 (0.52) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084168 0.80 HRH4 (0.52) HRH4HRH3HRH1HRH2BCHE
SCHEMBL14084172 0.79 HRH4 (0.50) HRH4HRH3HRH1HRH2BCHE
SCHEMBL607142 0.78 HRH4 (0.52) HRH4BCHEKDRBRD4ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10195195-B2 Selective histamine H4 receptor antagonists for the treatment of vestibular disorders INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2019-02-05 — — US disclosed
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
US-20170056397-A1 SELECTIVE HISTAMINE H4 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF VESTIBULAR DISORDERS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2017-03-02 — — 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
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