SCHEMBL11567415

SCHEMBL11567415

CN(C)CCCN1c2c[c]ccc2Sc2ccccc21

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 9/20 0.76
CYP1A2 P05177 8/20 0.76
HTR1A P08908 5/20 0.76
TP53 P04637 5/20 0.76
KDM1A O60341 4/20 0.76
CHRM2 P08172 4/20 0.76
ADRA2A P08913 4/20 0.76
CHRM1 P11229 4/20 0.76
DRD1 P21728 4/20 0.76
SLC6A2 P23975 4/20 0.76
SLC6A4 P31645 4/20 0.76
ADRA1A P35348 4/20 0.76
OPRM1 P35372 4/20 0.76
DRD3 P35462 4/20 0.76
KCNH2 Q12809 4/20 0.76
DRD2 P14416 4/20 0.76
CYP2C19 P33261 4/20 0.76
THPO P40225 4/20 0.76
MTOR P42345 4/20 0.76
TSHR P16473 4/20 0.76

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
Promazine SCHEMBL9052694 0.87 CYP2D6 (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL140489 0.87 CYP2D6 (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL29392545 0.87 CYP2D6 (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL123418 0.86 LMNA (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL29390978 0.86 LMNA (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL27429489 0.86 CYP2D6 (0.97) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL27425063 0.86 CYP2D6 (0.97) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL123419 0.84 CYP2D6 (0.94) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL28239574 0.83 CYP2D6 (0.91) CYP2D6CYP1A2HTR1ATP53KDM1A
SCHEMBL6865346 0.83 CYP2D6 (0.90) CYP2D6CYP1A2HTR1ATP53KDM1A

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-0002236-A1 Peptides, their salts, their acid addition salts, pharmaceutical formulations containing them and their use as morphine antagonists and anaesthetics THE WELLCOME FOUNDATION LIMITED (GB) 1979-06-13 EP disclosed