SCHEMBL34459999

SCHEMBL34459999

CC(C)(C)OC(=O)NCCN1CCN(Cc2ccccn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.58
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 4/20 0.50
SIGMAR1 Q99720 2/20 0.49
POLB P06746 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
HRH1 P35367 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HTR1A P08908 1/20 0.47
ADRA1A P35348 1/20 0.47
CACNA1H O95180 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL23775653 1.00 DRD2 (0.58) DRD2KDM4EALDH1A1SIGMAR1POLB
SCHEMBL25401086 0.83 KDM4E (0.52) KDM4EALDH1A1POLBCYP2D6CYP2C19
SCHEMBL29263714 0.82 KDM4E (0.55) DRD2KDM4EPOLBCYP2D6CYP2C19
SCHEMBL31301273 0.82 DRD2 (0.64) DRD2SIGMAR1
SCHEMBL3440056 0.82 DRD2 (0.64) DRD2SIGMAR1
SCHEMBL23751086 0.82 KDM4E (0.60) KDM4EALDH1A1POLBCYP2D6CYP2C19
SCHEMBL1307345 0.81 DRD2 (0.55) DRD2ALDH1A1SIGMAR1HTR1AADRA1A
SCHEMBL23775793 0.81 DRD2 (0.55) DRD2SIGMAR1
SCHEMBL2137893 0.80 ALDH1A1 (0.68) KDM4EALDH1A1POLBCYP2C19HRH1
SCHEMBL17986173 0.80 KDM4E (0.55) KDM4EALDH1A1POLBCYP2C19HRH1

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-3796900-B1 TRITERPENE AMINE DERIVATIVES DFH THERAPEUTICS (US) 2026-04-08 EP disclosed