SCHEMBL2407642

SCHEMBL2407642

O=C(O)N(CCC1CCN(c2ccc(-c3cccc(Cl)c3)cn2)CC1)Cc1nccs1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.44
MGLL Q99685 1/20 0.41
AOC3 Q16853 5/20 0.41
DGAT1 O75907 6/20 0.40
KCNH2 Q12809 3/20 0.40
EGLN1 Q9GZT9 1/20 0.40
ADORA2A P29274 2/20 0.39
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CTSA P10619 1/20 0.37
GRM5 P41594 2/20 0.36
MAPK8 P45983 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 0.91 AOC3 (0.41) AOC3DGAT1KCNH2ADORA2APDE4A
SCHEMBL2411687 0.91 DGAT1 (0.41) MGLLAOC3DGAT1KCNH2EGLN1
SCHEMBL2407424 0.88 MCHR1 (0.43) AOC3DGAT1KCNH2PDE4APDE4B
SCHEMBL2404039 0.86 DGAT1 (0.41) DGAT1KCNH2ADORA2A
SCHEMBL2408002 0.84 TRPM8 (0.41) AOC3DGAT1
SCHEMBL2406534 0.84 DGAT1 (0.42) DGAT1KCNH2EGLN1
SCHEMBL2406077 0.82 PDE10A (0.45) DGAT1KCNH2ADORA2AGRM5
SCHEMBL2329208 0.75 CNR2 (0.54) CNR2MGLLDGAT1KCNH2EGLN1
SCHEMBL2431551 0.74 MCHR1 (0.39) DGAT1KCNH2ADORA2A
SCHEMBL2406147 0.73 AOC3 (0.38) AOC3DGAT1

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 CNR2 86/4885MGLL 2325/4885AOC3 769/4885

“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.