SCHEMBL6865346

SCHEMBL6865346

CN(C)CCCCN1c2ccccc2Sc2ccccc21

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 9/20 0.90
CYP1A2 P05177 8/20 0.90
HTR1A P08908 5/20 0.90
TP53 P04637 5/20 0.90
KDM1A O60341 4/20 0.90
DRD2 P14416 4/20 0.90
CYP2C19 P33261 4/20 0.90
CHRM2 P08172 4/20 0.90
ADRA2A P08913 4/20 0.90
CHRM1 P11229 4/20 0.90
DRD1 P21728 4/20 0.90
SLC6A2 P23975 4/20 0.90
SLC6A4 P31645 4/20 0.90
ADRA1A P35348 4/20 0.90
OPRM1 P35372 4/20 0.90
DRD3 P35462 4/20 0.90
KCNH2 Q12809 4/20 0.90
THPO P40225 4/20 0.90
MTOR P42345 4/20 0.90
SIGMAR1 Q99720 4/20 0.90

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 SCHEMBL29392545 0.95 CYP2D6 (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL140489 0.95 CYP2D6 (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL9052694 0.95 CYP2D6 (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL123418 0.93 LMNA (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL27425063 0.93 CYP2D6 (0.97) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL29390978 0.93 LMNA (1.00) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL27429489 0.93 CYP2D6 (0.97) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL123419 0.92 CYP2D6 (0.94) CYP2D6CYP1A2HTR1ATP53KDM1A
Promazine SCHEMBL28239574 0.90 CYP2D6 (0.91) CYP2D6CYP1A2HTR1ATP53KDM1A
Fenethazine SCHEMBL29394568 0.88 KDM1A (1.00) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030032801-A1 Chemosensitizing agents against chloroquine resistant plasmodium falciparum and methods of making and using thereof U.S. ARMY MEDICAL RESEARCH AND MATERIEL COMMAND 2003-02-13 US claimed
WO-2002089810-A1 CHEMOSENSITIZING AGENTS AGAINST CHLOROQUINE RESISTANT PLASMODIUM FALCIPARUM AND METHODS OF MAKING AND USING THEREOF UNITED STATES ARMY MEDICAL RESEARCH AND MATERIEL COMMAND (US) 2002-11-14 WO claimed
US-6800618-B2 PHENOTHIAZINE OR IMINODIBENZYL DERIVATIVES AS ANTIMALARIAL AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY 2004-10-05 US disclosed
US-20030032801-A1 Chemosensitizing agents against chloroquine resistant plasmodium falciparum and methods of making and using thereof U.S. ARMY MEDICAL RESEARCH AND MATERIEL COMMAND 2003-02-13 US disclosed
WO-2002089810-A1 CHEMOSENSITIZING AGENTS AGAINST CHLOROQUINE RESISTANT PLASMODIUM FALCIPARUM AND METHODS OF MAKING AND USING THEREOF UNITED STATES ARMY MEDICAL RESEARCH AND MATERIEL COMMAND (US) 2002-11-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030032801-A1 Chemosensitizing agents against chloroquine resistant plasmodium falciparum and methods of making and using thereof ABCC1, SLC11A2, G6PD CYP2D6 31/4885CYP1A2 374/4885HTR1A 3269/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.