SCHEMBL10668657

SCHEMBL10668657

CCNC(=S)NNC(=O)NCCCOc1cccc(CN2CCCCC2)c1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.62
HRH3 Q9Y5N1 1/20 0.62

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
SCHEMBL10675639 0.96 HRH2 (0.62) HRH2HRH3
SCHEMBL10670272 0.94
SCHEMBL10672985 0.93 HRH2 (0.67) HRH2HRH3
SCHEMBL10671604 0.93 HRH2 (0.62) HRH2HRH3
SCHEMBL10672254 0.91 HRH2 (0.63) HRH2HRH3
SCHEMBL10671398 0.90 HRH2 (0.63) HRH2HRH3
Dalcotidine SCHEMBL1815082 0.89 HRH2 (0.70) HRH2HRH3
Dalcotidine SCHEMBL29395522 0.89 HRH2 (0.70) HRH2HRH3
SCHEMBL10673260 0.88 HRH2 (0.58) HRH2HRH3
SCHEMBL10672937 0.88 HRH2 (0.61) HRH2HRH3

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
US-4727081-A ANTIULCER AGENTS LUDWIG HEUMANN & CO. GMBH (DE) 1988-02-23 US disclosed
EP-0180754-A2 3,4-Diazole derivatives, process for their preparation and medicines containing these compounds LUDWIG HEUMANN & CO GMBH (DE) 1986-05-14 EP disclosed