SCHEMBL1815188

SCHEMBL1815188

CC(=O)O[C@@H](C)OC(=O)NCCC[C@H](CCCC(C)C)CCC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.36
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ADRA1A P35348 1/20 0.33
PTPN1 P18031 1/20 0.32
PLA2G10 O15496 1/20 0.31
ECE1 P42892 1/20 0.30

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
SCHEMBL1817362 1.00 FOLH1 (0.36) FOLH1MEN1GAAKMT2AKDM4C
SCHEMBL1814083 0.90 FOLH1 (0.41) FOLH1MEN1GAAKMT2AADRA1A
SCHEMBL1814511 0.90 FOLH1 (0.41) FOLH1MEN1GAAKMT2AADRA1A
SCHEMBL1812967 0.90 FOLH1 (0.41) FOLH1MEN1GAAKMT2AADRA1A
SCHEMBL1815224 0.90 FOLH1 (0.41) FOLH1MEN1GAAKMT2AADRA1A
SCHEMBL1815319 0.89 FOLH1 (0.35) FOLH1MEN1GAAKMT2AKDM4C
SCHEMBL1817347 0.89 FOLH1 (0.35) FOLH1MEN1GAAKMT2AKDM4C
SCHEMBL1812960 0.88 FOLH1 (0.37) FOLH1MEN1GAAKMT2AKDM4C
SCHEMBL1818208 0.88 FOLH1 (0.37) FOLH1MEN1GAAKMT2AKDM4C
SCHEMBL1814427 0.88 FOLH1 (0.34) FOLH1MEN1GAAKMT2AKDM4C

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-20110124705-A1 PRODRUGS OF ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2011-05-26 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-20110124705-A1 PRODRUGS OF ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CHRND, CHRNE, CHRNG FOLH1 305/4885MEN1 2810/4885GAA 422/4885

“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.