SCHEMBL7565775

SCHEMBL7565775

C=C(C)C(C)(N)N1CC[N]C(N2CCN(S(C)(=O)=O)CC2)C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 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
SCHEMBL4637085 0.71 ALDH1A1 (0.36) KDM4EALDH1A1MAPT
SCHEMBL7481477 0.62 RECQL (0.31)
SCHEMBL20458885 0.60 LMNA (0.37) KDM4EALDH1A1MAPT
SCHEMBL20840303 0.56 LMNA (0.50) KDM4EALDH1A1MAPT
SCHEMBL737197 0.56
SCHEMBL4778694 0.56 LMNA (0.50) KDM4EALDH1A1MAPT
SCHEMBL11916121 0.56 ALDH1A1 (0.53) KDM4EALDH1A1MAPT
SCHEMBL680281 0.56 LMNA (0.39) KDM4EALDH1A1MAPT
SCHEMBL21038324 0.55 ALDH1A1 (0.41) KDM4EALDH1A1MAPT
SCHEMBL3232984 0.55 TSHR (0.36) KDM4EALDH1A1MAPT

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-1252153-A1 SUBSTITUTED PIPERIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, AND METHODS FOR THE PRODUCTION THEREOF Boehringer Ingelheim Pharma KG (DE) 2002-10-30 EP claimed
WO-2001049676-A1 SUBSTITUTED PIPERIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-07-12 WO claimed