SCHEMBL3377403

SCHEMBL3377403

Cc1cccc(OC(=O)N(C)CC2CC(Oc3ccc(CN4CCCC4)cc3)C2)n1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
KCNH2 Q12809 8/20 0.42
MCHR1 Q99705 7/20 0.42
HRH3 Q9Y5N1 3/20 0.39
ADRB2 P07550 4/20 0.39
MEN1 O00255 2/20 0.39
LSS P48449 1/20 0.38

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
SCHEMBL3380203 0.88 HRH3 (0.48) KMT2AKCNH2MCHR1HRH3MEN1
SCHEMBL3380337 0.86 KCNH2 (0.42) KMT2AKCNH2MCHR1HRH3ADRB2
SCHEMBL3377330 0.85 KMT2A (0.45) KMT2AKCNH2MCHR1HRH3ADRB2
SCHEMBL3378211 0.84 HRH3 (0.40) KMT2AMCHR1HRH3MEN1
SCHEMBL3381197 0.82 HRH3 (0.39) KMT2AKCNH2MCHR1HRH3ADRB2
SCHEMBL3376704 0.81 KCNH2 (0.44) KMT2AKCNH2MCHR1HRH3ADRB2
SCHEMBL3377718 0.81 KCNH2 (0.42) KMT2AKCNH2MCHR1HRH3ADRB2
SCHEMBL3378010 0.80 HRH3 (0.49) KMT2AHRH3ADRB2MEN1
SCHEMBL3378007 0.80 HRH3 (0.49) KMT2AHRH3ADRB2MEN1
SCHEMBL3376176 0.80 HRH3 (0.53) KMT2AKCNH2MCHR1HRH3ADRB2

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
EP-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP claimed