SCHEMBL345160

SCHEMBL345160

CC(C)c1nc(CC(NC(=O)O)C2CCN(c3nnc(Cl)c4ccccc34)CC2)no1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
GFER P55789 1/20 0.36
MAPT P10636 1/20 0.35
OPRK1 P41145 2/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
PKM P14618 1/20 0.33
TSHR P16473 1/20 0.33
P2RY12 Q9H244 2/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
LMNA P02545 2/20 0.32
MGLL Q99685 1/20 0.32
TP53 P04637 1/20 0.32
NPY2R P49146 1/20 0.32

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
SCHEMBL345161 0.78 MEN1 (0.36) MEN1KMT2AGFEROPRK1PKM
SCHEMBL346095 0.75 ACACB (0.44) MEN1KMT2AALDH1A1PKMTSHR
SCHEMBL2125396 0.68 MEN1 (0.55) MEN1KMT2AGFERMAPTALDH1A1
SCHEMBL5800004 0.67 HRH4 (0.49) ALDH1A1
SCHEMBL16162195 0.67 MEN1 (0.51) MEN1KMT2AGFERALDH1A1PKM
SCHEMBL15662150 0.64 MEN1 (0.47) MEN1KMT2AGFERMAPTALDH1A1
SCHEMBL1267034 0.64 MEN1 (0.52) MEN1KMT2AGFERPKMTSHR
SCHEMBL239312 0.64 HRH4 (0.45) ALDH1A1
SCHEMBL345705 0.64 SORD (0.41)
SCHEMBL345397 0.64 MEN1 (0.38) MEN1KMT2AGFERPOLBPKM

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MEN1 812/4885KMT2A 2849/4885GFER 2140/4885

“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.