SCHEMBL4643973

SCHEMBL4643973

CCOc1ccccc1NC(=O)N(C)CC1CC(Oc2ccc(CN3CCCC3)c(Cl)c2)C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.47
TDP1 Q9NUW8 1/20 0.43
CCR1 P32246 1/20 0.41
HRH1 P35367 1/20 0.41
CCR3 P51677 1/20 0.41
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 3/20 0.39
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MLNR O43193 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
SCHEMBL3377150 0.92 HRH3 (0.48) HRH3HRH1CCR3KMT2AMEN1
SCHEMBL3377928 0.90 HRH3 (0.49) HRH3HRH1CCR3KMT2AMEN1
SCHEMBL3378180 0.90 HRH3 (0.51) HRH3HRH1CCR3KMT2AMEN1
SCHEMBL3380049 0.89 HRH3 (0.49) HRH3CCR1HRH1CCR3KMT2A
SCHEMBL3380634 0.88 HRH3 (0.49) HRH3HRH1CCR3KMT2AMEN1
SCHEMBL3377774 0.87 HRH3 (0.49) HRH3HRH1CCR3MAPTALDH1A1
SCHEMBL3378477 0.86 HRH3 (0.54) HRH3HRH1CCR3SMN1; SMN2
SCHEMBL3380104 0.86 HRH3 (0.47) HRH3TDP1HRH1CCR3KMT2A
SCHEMBL3379929 0.85 HRH3 (0.49) HRH3ALDH1A1SMN1; SMN2MLNR
SCHEMBL3380421 0.84 HRH3 (0.53) HRH3HRH1CCR3KMT2AMEN1

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
EP-1899296-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2008-03-19 EP claimed
WO-2006136924-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-12-28 WO claimed