SCHEMBL345397

SCHEMBL345397

CNC(=O)c1cc(CN(C(=O)O)C2CCN(c3nnc(Cl)c4ccccc34)CC2)on1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GFER P55789 1/20 0.38
CDK1 P06493 3/20 0.36
IGF1R P08069 3/20 0.36
FGFR1 P11362 3/20 0.36
BRAF P15056 3/20 0.36
FGFR2 P21802 3/20 0.36
FGFR4 P22455 3/20 0.36
FGFR3 P22607 3/20 0.36
JAK1 P23458 3/20 0.36
CDK2 P24941 3/20 0.36
AXL P30530 3/20 0.36
CDK5 Q00535 3/20 0.36
PTK2B Q14289 3/20 0.36
RIPK1 Q13546 5/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL345098 0.84 SCD (0.35) MEN1KMT2AGFERRIPK1SMN1; SMN2
SCHEMBL344750 0.76 HRH4 (0.43) MEN1KMT2ARIPK1SMN1; SMN2
SCHEMBL345166 0.74 CHRM4 (0.43) MEN1KMT2APKMTSHRSMN1; SMN2
SCHEMBL1267034 0.73 MEN1 (0.52) MEN1KMT2AGFERPKMTSHR
SCHEMBL345427 0.72 HTR7 (0.43) KMT2ACDK2SMN1; SMN2
SCHEMBL345426 0.72 HTR7 (0.43) KMT2ACDK2SMN1; SMN2
SCHEMBL16269780 0.71 MEN1 (0.52) MEN1KMT2AGFERCDK1IGF1R
SCHEMBL16162195 0.68 MEN1 (0.51) MEN1KMT2AGFERPKMTSHR
SCHEMBL9993011 0.67 HRH3 (0.39)
SCHEMBL345161 0.67 MEN1 (0.36) MEN1KMT2AGFERPKMTSHR

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.