SCHEMBL9730561

SCHEMBL9730561

CN(C)CC1CCCCCN1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
TSHR P16473 1/20 0.47
MLNR O43193 1/20 0.47
ABCB11 O95342 1/20 0.47
EGFR P00533 1/20 0.47
FYN P06241 1/20 0.47
CHRM2 P08172 1/20 0.47
CHRM4 P08173 1/20 0.47
HTR1A P08908 1/20 0.47
CHRM5 P08912 1/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
ADRA2B P18089 1/20 0.47

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
SCHEMBL10560492 0.98 CYP2D6 (0.44) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL1233909 0.98 CYP2D6 (0.44) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL9122889 0.98 CYP2D6 (0.44) CYP2D6MEN1LMNATP53KMT2A
Hydrochloric Acid SCHEMBL1190314 0.96 KMT2A (0.42) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL588857 0.91
SCHEMBL1401177 0.91
SCHEMBL10059315 0.91
Hydrochloric Acid SCHEMBL20520978 0.89 GHSR (0.35) CYP2D6MEN1LMNATP53KMT2A
Hydrochloric Acid SCHEMBL22495082 0.89 GHSR (0.35) CYP2D6MEN1LMNATP53KMT2A
Hydrochloric Acid SCHEMBL1190877 0.89 GHSR (0.35) CYP2D6MEN1LMNATP53KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE33906-E Cyclic carboxamide derivatives and their use as analgesics DR.LO.ZAMBELETTI S.P.A. (IT) 1992-04-28 US disclosed
EP-0232612-B1 AZACYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS PHARMACEUTICALS Dr. Lo. Zambeletti S.p.A. (IT) 1990-04-04 EP disclosed
US-4801585-A Cyclic carboxamide derivatives and their use as analgesics DR.LO.ZAMBELETTI S.P.A. (IT) 1989-01-31 US disclosed
EP-0232612-A1 Azacyclic compounds, processes for their preparation, and their use as pharmaceuticals Dr. Lo. Zambeletti S.p.A. (IT) 1987-08-19 EP disclosed