SCHEMBL2406077

SCHEMBL2406077

O=C(O)N(CCC1CCN(c2ccc3cc(Cl)ccc3n2)CC1)Cc1nccs1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.45
HRH3 Q9Y5N1 2/20 0.43
HRH4 Q9H3N8 2/20 0.43
HTR3A P46098 1/20 0.43
MCHR1 Q99705 3/20 0.37
DGAT1 O75907 2/20 0.37
KCNH2 Q12809 2/20 0.37
GRM5 P41594 1/20 0.36
PPARG P37231 5/20 0.36
PPARD Q03181 5/20 0.36
PPARA Q07869 4/20 0.36
ADORA2A P29274 1/20 0.36
ACACB O00763 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
SCHEMBL2408009 0.85 HRH3 (0.42) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL2411687 0.83 DGAT1 (0.41) HRH3MCHR1DGAT1KCNH2ADORA2A
SCHEMBL2407608 0.83 HRH3 (0.43) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL2406511 0.83 PDE10A (0.43) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL2407749 0.82 HRH3 (0.42) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL2407642 0.82 CNR2 (0.44) DGAT1KCNH2GRM5ADORA2A
SCHEMBL1727924 0.81 HRH3 (0.48) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL2406996 0.81 HRH3 (0.41) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL2406343 0.80 PDE10A (0.41) PDE10AHRH3HRH4HTR3AMCHR1
SCHEMBL1729306 0.79 HRH3 (0.46) PDE10AHRH3HRH4HTR3AMCHR1

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 PDE10A 2001/4885HRH3 42/4885HRH4 19/4885

“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.