SCHEMBL345745

SCHEMBL345745

CNC(=O)c1cc(N(CCC2(N(C)C)CN(C(=O)OC(C)(C)C)C2)C(=O)OC)on1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 3/20 0.35
SCD O00767 2/20 0.33
USP30 Q70CQ3 2/20 0.33
PKM P14618 1/20 0.33
GPR119 Q8TDV5 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
KDM1A O60341 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
RCOR1 Q9UKL0 1/20 0.30
PIK3R1 P27986 1/20 0.30
PIK3CA P42336 1/20 0.30

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
SCHEMBL346246 0.86 PKM (0.39) SCD5SCDUSP30PKMGPR119
SCHEMBL345095 0.83 PKM (0.38) SCD5SCDUSP30PKMGPR119
SCHEMBL9994672 0.78 SCD5 (0.43) SCD5USP30PKMGPR119
SCHEMBL345714 0.76 USP30 (0.41) USP30PKMGPR119
SCHEMBL345746 0.75 SCD5 (0.34) SCD5SCDUSP30PKM
SCHEMBL346029 0.71 PKM (0.38) SCD5SCDUSP30PKMGPR119
SCHEMBL9993013 0.68 NAMPT (0.46) SCD5PKMGPR119JAK2JAK1
SCHEMBL346187 0.66 DDB1 (0.40) GPR119JAK2JAK1PIK3R1PIK3CA
SCHEMBL24359183 0.65 USP2 (0.40) USP30GPR119JAK2JAK1
SCHEMBL24359182 0.64 NR1H2 (0.43) GPR119JAK2JAK1PIK3R1PIK3CA

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-8716289-B2 Carbamate derivatives of alkyl-heterocycles, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-05-06 US disclosed
US-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2012-01-19 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-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF INTS9, CDK8, SCN8A SCD5 4185/4885SCD 4792/4885USP30 4160/4885

“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.