SCHEMBL5463441

SCHEMBL5463441

CCCC(=NOC)c1ccc(COC)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.44
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC6A4 P31645 4/20 0.37
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
FFAR1 O14842 1/20 0.35
PKM P14618 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
CA2 P00918 1/20 0.34
DRD4 P21917 2/20 0.33
HSD17B3 P37058 1/20 0.33
DRD2 P14416 1/20 0.33

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
SCHEMBL5463436 1.00 GSK3B (0.44) GSK3BMEN1KMT2ASLC6A4KDM4E
SCHEMBL5451892 0.85 SMN1; SMN2 (0.47) MEN1KMT2AKDM4ESMN1; SMN2PKM
SCHEMBL5451890 0.85 SMN1; SMN2 (0.47) MEN1KMT2AKDM4ESMN1; SMN2PKM
SCHEMBL5448513 0.83 L3MBTL1 (0.41) MEN1KMT2ASLC6A4KDM4ESMN1; SMN2
SCHEMBL5448519 0.83 L3MBTL1 (0.41) MEN1KMT2ASLC6A4KDM4ESMN1; SMN2
SCHEMBL5457052 0.83 GSK3B (0.46) GSK3BMEN1KMT2ASLC6A4KDM4E
SCHEMBL5457045 0.83 GSK3B (0.46) GSK3BMEN1KMT2ASLC6A4KDM4E
SCHEMBL5461219 0.79 ATM (0.48) GSK3BKMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL5461220 0.79 ATM (0.48) GSK3BKMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL16202068 0.77 DRD4 (0.49) GSK3BMEN1KMT2AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420679-B2 Aminothiazole derivatives and their use as CRF receptor ligands SANOFI (FR) 2013-04-16 US disclosed
US-20070281919-A1 Aminothiazole Derivatives And Their Use As CRF Receptor Ligands SANOFI-AVENTIS (FR) 2007-12-06 US disclosed
EP-1200419-B1 AMINOTHIAZOLE DERIVATIVES AND THEIR USE AS CRF RECEPTOR LIGANDS SANOFI SYNTHELABO (FR) 2004-04-14 EP disclosed
US-6586456-B1 Corticotropin releasing factor (CRF) antagonists such as (4-(2-chloro-4-methoxy-5-methylphenyl)-5-methylthiazol-2-yl)(( (1-(3-fluoro-4-methylphenyl)-2-methoxyethyl))prop-2-ynylamine, prepared by alkylation with propagyl bromide SANOFI-SYNTHELABO (FR) 2003-07-01 US disclosed
EP-1200419-A1 AMINOTHIAZOLE DERIVATIVES AND THEIR USE AS CRF RECEPTOR LIGANDS SANOFI-SYNTHELABO (FR) 2002-05-02 EP disclosed
WO-2001005776-A1 AMINOTHIAZOLE DERIVATIVES AND THEIR USE AS CRF RECEPTOR LIGANDS SANOFI-SYNTHELABO (FR) 2001-01-25 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-20070281919-A1 Aminothiazole Derivatives And Their Use As CRF Receptor Ligands CRH, CRHR1, CRHR2 GSK3B 4369/4885MEN1 2126/4885KMT2A 2839/4885

“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.