SCHEMBL11048034

SCHEMBL11048034

CN1CC2CN(C)CC(C1)C2OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
TACR1 P25103 6/20 0.46
PDPK1 O15530 1/20 0.44
MTOR P42345 1/20 0.44
HRH3 Q9Y5N1 2/20 0.43
TMEM97 Q5BJF2 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
PRMT8 Q9NR22 1/20 0.43
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
CYP2C19 P33261 1/20 0.40

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
SCHEMBL9965812 0.81 CTSL (0.62) CTSLCTSBCTSKHRH3TMEM97
SCHEMBL10635696 0.81 TACR1 (0.38) CTSLCTSBCTSKTACR1HRH3
SCHEMBL10635693 0.81 TACR1 (0.38) CTSLCTSBCTSKTACR1HRH3
SCHEMBL10635698 0.81 TACR1 (0.38) CTSLCTSBCTSKTACR1HRH3
SCHEMBL14256118 0.79 CTSL (0.54) CTSLCTSBCTSKHRH3TMEM97
SCHEMBL19013836 0.77 CHRM2 (0.40) TACR1HRH3
SCHEMBL19014182 0.77 CHRM2 (0.40) TACR1HRH3
SCHEMBL19014184 0.77 JAK2 (0.41) TACR1CARM1PRMT6PRMT8
SCHEMBL19014052 0.76 TACR1 (0.47) CTSLCTSBCTSKTACR1PDPK1
SCHEMBL20682195 0.76 TACR1 (0.44) CTSLCTSBCTSKTACR1PDPK1

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
US-4451473-A 3,7-Diazabicyclo [3.3.1] nonanes having anti-arrhythmic activity RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1984-05-29 US disclosed