SCHEMBL5457069

SCHEMBL5457069

CCC[C@H](NC(N)=S)c1ccc2c(c1)OCO2

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TAS1R3 Q7RTX0 4/20 0.46
TAS1R1 Q7RTX1 4/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 2/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
UTS2R Q9UKP6 1/20 0.42
ADRA2A P08913 1/20 0.41
MCHR1 Q99705 1/20 0.41
F2 P00734 1/20 0.41
ELANE P08246 1/20 0.41
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41

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
SCHEMBL9271139 0.87 TAS1R3 (0.52) RAB9ATAS1R3TAS1R1MEN1KMT2A
SCHEMBL5469969 0.83 RAB9A (0.52) RAB9ASMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL5454428 0.81 SMN1; SMN2 (0.46) RAB9ASMN1; SMN2MEN1KMT2AHPGD
SCHEMBL987091 0.80 MEN1 (0.49) SMN1; SMN2TAS1R3TAS1R1MEN1KMT2A
SCHEMBL5493126 0.75 AOC3 (0.53) TAS1R3TAS1R1MEN1KMT2AKDM4E
SCHEMBL8712770 0.75 AOC3 (0.53) TAS1R3TAS1R1MEN1KMT2AKDM4E
SCHEMBL29839165 0.74 TAS1R3 (0.50) TAS1R3TAS1R1MEN1KMT2AKDM4E
SCHEMBL7420094 0.74 TAS1R3 (0.50) TAS1R3TAS1R1MEN1KMT2AKDM4E
SCHEMBL7392624 0.74 TAS1R3 (0.50) TAS1R3TAS1R1MEN1KMT2AKDM4E
SCHEMBL5469966 0.74 TAS1R3 (0.50) TAS1R3TAS1R1MEN1KMT2AKDM4E

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 RAB9A 3096/4885SMN1; SMN2 4326/4885TAS1R3 934/4885

“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.