SCHEMBL18667948

SCHEMBL18667948

C=C(C)N1CCN(C2CCOCC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.46

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
SCHEMBL25639671 0.86 PHGDH (0.39) HRH3
SCHEMBL23712050 0.81 SMN1; SMN2 (0.55) HRH3
SCHEMBL21568056 0.77 HRH3 (0.38) HRH3
SCHEMBL21204595 0.75 HRH3 (0.37) HRH3
SCHEMBL3590803 0.74 HRH3 (0.55) HRH3
SCHEMBL19288816 0.74 L3MBTL3 (0.44) HRH3
SCHEMBL21739821 0.74 L3MBTL3 (0.42)
SCHEMBL18177695 0.74 OPRL1 (0.39)
SCHEMBL19313040 0.74 KMT2A (0.45)
SCHEMBL18177696 0.74 OPRL1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017045750-A1 COMPOUNDS AS ASIC INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2017-03-23 WO disclosed