SCHEMBL7979288

SCHEMBL7979288

CC[C@@H](N)C(=O)N1CCN([C@H](C)CCOC2=CC[CH]C=C2)CC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 8/20 0.38
HRH1 P35367 8/20 0.38
KDM4E B2RXH2 1/20 0.34
HRH3 Q9Y5N1 3/20 0.31
DRD3 P35462 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
CHRM1 P11229 2/20 0.30
GPR183 P32249 1/20 0.30

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
SCHEMBL7979285 0.76 HRH2 (0.48) HRH2HRH1HRH3DRD3
SCHEMBL7978323 0.76 HRH2 (0.54) HRH2HRH1HRH3
SCHEMBL7980024 0.74 HRH2 (0.51) HRH2HRH1HRH3
SCHEMBL7243633 0.72 HRH2 (0.72) HRH2HRH1HRH3
SCHEMBL7978201 0.69 HRH2 (0.58) HRH2HRH1
SCHEMBL25910102 0.67 CHRM1 (0.44) HRH2HRH1HRH3DPP7CHRM1
SCHEMBL14148845 0.67
SCHEMBL7246172 0.65 HRH2 (0.74) HRH2HRH1HRH3
SCHEMBL28132610 0.64 DPP7 (0.49) HRH2HRH1DPP7
SCHEMBL28132609 0.64 DPP7 (0.49) HRH2HRH1DPP7

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-2001066534-A2 CYCLIC AND BICYCLIC DIAMINO HISTAMINE-3 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2001-09-13 WO disclosed