SCHEMBL2404239

SCHEMBL2404239

Cc1nc(CN(CCC2CCN(c3ccc(-c4ccc(F)cc4)cn3)CC2)C(=O)O)cs1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
MCHR1 Q99705 5/20 0.40
DGAT1 O75907 5/20 0.40
CHRM4 P08173 2/20 0.39
HRH3 Q9Y5N1 2/20 0.37
ADORA2A P29274 3/20 0.37
KCNH2 Q12809 3/20 0.37
HTR1A P08908 1/20 0.37
DRD4 P21917 1/20 0.37
HTR2A P28223 1/20 0.37
SLC6A4 P31645 1/20 0.37
DRD3 P35462 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
SCD O00767 1/20 0.36
ENPP2 Q13822 1/20 0.35

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
SCHEMBL2405880 0.87 CKS1B (0.40) CKS1BSKP1SKP2MCHR1CHRM4
SCHEMBL2405344 0.85 DGAT1 (0.39) CKS1BSKP1SKP2MCHR1DGAT1
SCHEMBL2406938 0.82 DGAT1 (0.39) CKS1BSKP1SKP2MCHR1DGAT1
SCHEMBL2404039 0.82 DGAT1 (0.41) CKS1BSKP1SKP2MCHR1DGAT1
SCHEMBL1727605 0.80 DGAT1 (0.44) CKS1BSKP1SKP2MCHR1DGAT1
SCHEMBL2407749 0.77 HRH3 (0.42) MCHR1DGAT1CHRM4HRH3KCNH2
SCHEMBL2407178 0.76 DGAT1 (0.37) MCHR1DGAT1CHRM4HRH3
SCHEMBL2406228 0.74 AOC3 (0.41) CKS1BSKP1SKP2DGAT1CHRM4
SCHEMBL2407375 0.74 CKS1B (0.40) CKS1BSKP1SKP2MCHR1HTR1A
SCHEMBL2404241 0.74 HTR1A (0.37) CKS1BSKP1SKP2MCHR1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912218-B2 Alkylthiazol carbamate derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-12-16 US disclosed
US-20110212963-A1 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-09-01 US 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-20110212963-A1 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF MET, ALK, REL CKS1B 2188/4885SKP1 3476/4885SKP2 3826/4885

“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.