SCHEMBL346247

SCHEMBL346247

CNC(=O)c1cc(COC(=O)NCCC2(C)CCN(C(=O)OC(C)(C)C)CC2)on1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.40
SCD5 Q86SK9 3/20 0.38
GNRHR P30968 1/20 0.37
NAMPT P43490 6/20 0.37
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
SCD O00767 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 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
SCHEMBL345096 0.90 PKM (0.39) PKMSCD5GNRHRNAMPTKEAP1
SCHEMBL345746 0.86 SCD5 (0.34) PKMSCD5GNRHRPOLBKEAP1
SCHEMBL9994514 0.81 NAMPT (0.44) PKMSCD5NAMPTMEN1KMT2A
SCHEMBL9994673 0.80 NAMPT (0.47) PKMSCD5GNRHRNAMPTCYP2C9
SCHEMBL346030 0.80 PKM (0.40) PKMSCD5GNRHRNAMPTMEN1
SCHEMBL345715 0.79 KDM4E (0.46) PKMGNRHRNAMPTMEN1KMT2A
SCHEMBL345501 0.78 KMT2A (0.34) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL345709 0.75 ALDH1A1 (0.37) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL345678 0.75 POLB (0.35) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL346246 0.74 PKM (0.39) PKMSCD5NAMPTCYP2C9JAK2

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 PKM 2791/4885SCD5 4185/4885GNRHR 1495/4885

“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.