SCHEMBL6863702

SCHEMBL6863702

[CH](c1ccccc1)N([CH]c1ccccc1)CCCCCCOC1CCCCO1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4C Q9H3R0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
OPRM1 P35372 4/20 0.33
OPRK1 P41145 2/20 0.33
OPRD1 P41143 1/20 0.33
CHRM2 P08172 2/20 0.32
CHRM4 P08173 2/20 0.32
CHRM1 P11229 2/20 0.32
CHRM3 P20309 2/20 0.32
MGLL Q99685 1/20 0.32
TGFBR1 P36897 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6863966 1.00 MEN1 (0.49) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6865688 0.99 MEN1 (0.47) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6866046 0.79 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL8497259 0.79 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6863969 0.79 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6863705 0.79 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6865689 0.77 MEN1 (0.48) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL8500626 0.76 MEN1 (0.55) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL14469419 0.76 MEN1 (0.55) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL30416895 0.74 MEN1 (0.53) MEN1KMT2AKDM4CL3MBTL1NPC1

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-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 MEN1 4126/4885KMT2A 1755/4885KDM4C 3166/4885

“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.