SCHEMBL2404039

SCHEMBL2404039

O=C(O)N(CCC1CCN(c2ccc(-c3ccc(F)cc3)cn2)CC1)Cc1nccs1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 9/20 0.41
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
HRH3 Q9Y5N1 2/20 0.39
CHRM4 P08173 1/20 0.39
HTR1A P08908 1/20 0.38
DRD4 P21917 1/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
DRD3 P35462 1/20 0.38
MCHR1 Q99705 4/20 0.38
ADORA2A P29274 4/20 0.38
KCNH2 Q12809 4/20 0.38
SCD O00767 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
NAMPT P43490 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
SCHEMBL2406228 0.92 AOC3 (0.41) DGAT1CKS1BSKP1SKP2CHRM4
SCHEMBL2411687 0.91 DGAT1 (0.41) DGAT1HRH3MCHR1ADORA2AKCNH2
SCHEMBL2408002 0.89 TRPM8 (0.41) DGAT1HRH3CHRM4
SCHEMBL2406534 0.89 DGAT1 (0.42) DGAT1HRH3CHRM4KCNH2
SCHEMBL2431551 0.88 MCHR1 (0.39) DGAT1CKS1BSKP1SKP2HRH3
SCHEMBL2407642 0.86 CNR2 (0.44) DGAT1ADORA2AKCNH2
SCHEMBL2406938 0.84 DGAT1 (0.39) DGAT1CKS1BSKP1SKP2HRH3
SCHEMBL2407424 0.84 MCHR1 (0.43) DGAT1HRH3CHRM4MCHR1KCNH2
SCHEMBL2405344 0.82 DGAT1 (0.39) DGAT1CKS1BSKP1SKP2HRH3
SCHEMBL2404239 0.82 CKS1B (0.41) DGAT1CKS1BSKP1SKP2HRH3

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 DGAT1 4017/4885CKS1B 2188/4885SKP1 3476/4885

“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.