SCHEMBL3377452

SCHEMBL3377452

CCc1cc(OC(=O)N(C)CC2CC(Oc3cccc(CN4CCCC4)c3Cl)C2)no1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.40
POLB P06746 3/20 0.36
THRB P10828 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
P2RX7 Q99572 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GPR6 P46095 1/20 0.32

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
SCHEMBL3376099 0.91 HRH3 (0.40) HRH3POLBTHRBMEN1KMT2A
SCHEMBL3380335 0.90 HRH3 (0.39) HRH3POLBTHRBMEN1KMT2A
SCHEMBL3378194 0.86 HRH3 (0.47) HRH3POLBTHRBLMNA
SCHEMBL3381202 0.85 HRH3 (0.39) HRH3POLBMEN1KMT2AP2RX7
SCHEMBL3378211 0.85 HRH3 (0.40) HRH3POLBMEN1KMT2AP2RX7
SCHEMBL3378100 0.85 HRH3 (0.40) HRH3POLBMEN1KMT2AP2RX7
SCHEMBL3377338 0.85 HRH3 (0.40) HRH3POLBMEN1KMT2AP2RX7
SCHEMBL3377718 0.84 KCNH2 (0.42) HRH3THRBMEN1KMT2A
SCHEMBL3378522 0.84 HRH3 (0.40) HRH3POLBMEN1KMT2AP2RX7
SCHEMBL3379864 0.83 HRH3 (0.39) HRH3POLBMEN1KMT2AP2RX7

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