SCHEMBL3340646

SCHEMBL3340646

NC(=O)c1ncc(SCCN2CCCC2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
MAPT P10636 4/20 0.40
KMT2A Q03164 4/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALOX15 P16050 1/20 0.40
SIRT2 Q8IXJ6 3/20 0.39
SIRT1 Q96EB6 3/20 0.39
SIRT3 Q9NTG7 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TLR9 Q9NR96 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
HTT P42858 2/20 0.36
CHEK1 O14757 1/20 0.35
LTA4H P09960 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
SCHEMBL1347559 0.80 ALOX15 (0.48) MEN1MAPTKMT2AL3MBTL1KDM4E
SCHEMBL2669086 0.77 ALOX15 (0.41) MEN1MAPTKMT2AL3MBTL1KDM4E
SCHEMBL2669124 0.75 ALOX15 (0.43) MEN1MAPTKMT2AKDM4EALOX15
SCHEMBL3622722 0.73 CHEK1 (0.39) CHEK1LTA4H
SCHEMBL5875892 0.72 HSD17B10 (0.39) TSHRNPC1RAB9A
SCHEMBL30620404 0.72 SMN1; SMN2 (0.53) MEN1MAPTKMT2AL3MBTL1KDM4E
SCHEMBL13639771 0.70 CCNE2 (0.57) MEN1KMT2AKDM4EALDH1A1NPC1
SCHEMBL16762644 0.70 GRIN2B (0.40) L3MBTL1KDM4ELTA4HHRH3
SCHEMBL1000315 0.70 CCNE2 (0.41) MAPTSMN1; SMN2
SCHEMBL999780 0.70 CCNE2 (0.41) MAPTSMN1; SMN2

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
EP-2379517-B1 Arylcyclopropylacetamide derivatives useful as glucokinase activators LILLY CO ELI (US) 2013-08-28 EP disclosed
US-20100160395-A1 CYCLOPROPYL COMPOUNDS ELI LILLY AND COMPANY 2010-06-24 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-20100160395-A1 CYCLOPROPYL COMPOUNDS IAPP, GPR119, SLC5A2 MEN1 2668/4885MAPT 1990/4885KMT2A 4683/4885

“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.