SCHEMBL345746

SCHEMBL345746

CNC(=O)c1cc(COC(=O)NCCC2(N(C)C)CN(C(=O)OC(C)(C)C)C2)on1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 3/20 0.34
HDAC6 Q9UBN7 3/20 0.34
HDAC1 Q13547 2/20 0.34
PKM P14618 1/20 0.33
POLB P06746 1/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
USP30 Q70CQ3 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
SCD O00767 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
GNRHR P30968 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC8 Q9BY41 1/20 0.31

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
SCHEMBL345678 0.88 POLB (0.35) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL346247 0.86 PKM (0.40) SCD5PKMPOLBKEAP1NFE2L2
SCHEMBL345096 0.83 PKM (0.39) SCD5PKMKEAP1NFE2L2MEN1
Hydrochloric Acid SCHEMBL346452 0.81 POLB (0.34) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL9994673 0.77 NAMPT (0.47) SCD5PKMGNRHR
SCHEMBL345715 0.77 KDM4E (0.46) HDAC6PKMUSP30MEN1KMT2A
SCHEMBL345198 0.75 POLB (0.39) SCD5POLBMEN1KMT2ANPC1
SCHEMBL345745 0.75 SCD5 (0.35) SCD5PKMUSP30SCD
SCHEMBL9994514 0.74 NAMPT (0.44) SCD5PKMMEN1KMT2A
SCHEMBL346030 0.73 PKM (0.40) SCD5PKMMEN1KMT2ASCD

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 4185/4885HDAC6 706/4885HDAC1 196/4885

“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.