SCHEMBL4018413

SCHEMBL4018413

FC(F)Oc1cccc(C(c2nnnn2Cc2ccccc2)N2CCCN(C3CCC3)CC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 1.00

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
SCHEMBL8026068 1.00 HRH3 (1.00) HRH3
SCHEMBL4023931 0.92 HRH3 (0.85) HRH3
SCHEMBL4027922 0.91 HRH3 (0.83) HRH3
SCHEMBL4026493 0.91 HRH3 (1.00) HRH3
SCHEMBL4021657 0.88 HRH3 (0.82) HRH3
SCHEMBL4020966 0.88 HRH3 (1.00) HRH3
SCHEMBL4023048 0.87 HRH3 (1.00) HRH3
SCHEMBL8022551 0.84 HRH3 (0.82) HRH3
SCHEMBL4028362 0.84 HRH3 (0.82) HRH3
SCHEMBL4021527 0.84 HRH3 (0.81) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009095394-A1 DIAZEPANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-08-06 WO claimed
WO-2009095394-A1 DIAZEPANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-08-06 WO disclosed