SCHEMBL9265205

SCHEMBL9265205

CC(C)N1CC2CN(Cc3ccccc3)CC(C1)C2=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
FUCA1 P04066 2/20 0.46
HRH3 Q9Y5N1 1/20 0.46
S1PR1 P21453 1/20 0.44
S1PR5 Q9H228 1/20 0.44
GAA P10253 2/20 0.44
SIGMAR1 Q99720 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ACHE P22303 1/20 0.42

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
SCHEMBL2962712 0.87 FUCA1 (0.58) TACR1FUCA1S1PR1S1PR5GAA
SCHEMBL9635245 0.86 POLB (0.43) TACR1KDM4EMEN1KMT2AHRH3
SCHEMBL7225576 0.82 MC4R (0.53) FUCA1S1PR1S1PR5GAASIGMAR1
SCHEMBL20008958 0.82 GRIN2B (0.51) KDM4EMEN1KMT2AFUCA1HRH3
SCHEMBL19518531 0.80 FUCA1 (0.55) FUCA1S1PR1S1PR5GAASIGMAR1
SCHEMBL20417932 0.80 FUCA1 (0.55) FUCA1S1PR1S1PR5GAASIGMAR1
SCHEMBL30875889 0.80 FUCA1 (0.55) FUCA1S1PR1S1PR5GAASIGMAR1
SCHEMBL1514852 0.80 FUCA1 (0.55) FUCA1S1PR1S1PR5GAASIGMAR1
SCHEMBL18339637 0.80 FUCA1 (0.55) TACR1FUCA1S1PR1S1PR5GAA
SCHEMBL31327374 0.80 FUCA1 (0.55) TACR1FUCA1S1PR1S1PR5GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5468858-A Sudden death syndrome THE BOARD OF REGENTS OF OKLAHOMA STATE UNIVERSITY PHYSICAL SCIENCES (US) 1995-11-21 US disclosed
US-5110933-A Salts of 3-azabicyclo[3.3.1]nonanes as antiarrhythmic agents, and precursors thereof BOARD OF REGENTS OF OKLAHOMA STATE UNIVERSITY (US) 1992-05-05 US disclosed
WO-1991007405-A1 SALTS OF 3-AZABICYCLO[3.3.1]NONANES AS ANTIARRHYTHMIC AGENTS, AND PRECURSORS THEREOF THE BOARD OF REGENTS OF OKLAHOMA STATE UNIVERSITY (US) 1991-05-30 WO disclosed