SCHEMBL3377874

SCHEMBL3377874

Cc1nonc1OC(=O)N(C)CC1CC(Oc2cccc(CN3CCCC3)c2Cl)C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.39
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 2/20 0.33
P2RX7 Q99572 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MAPT P10636 1/20 0.31
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 1/20 0.31

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
SCHEMBL3378689 0.86 HRH3 (0.39) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3377595 0.85 HRH3 (0.38) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3381202 0.85 HRH3 (0.39) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3379710 0.85 HRH3 (0.48) HRH3LMNAGAAKDM4EALDH1A1
SCHEMBL3376099 0.85 HRH3 (0.40) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3378211 0.84 HRH3 (0.40) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3377338 0.84 HRH3 (0.40) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3381483 0.83 HRH3 (0.37) HRH3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3378100 0.83 HRH3 (0.40) HRH3LMNAMEN1KMT2AKDM4E
SCHEMBL3378988 0.82 HRH3 (0.45) HRH3MEN1KMT2AKDM4EALDH1A1

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