SCHEMBL25700613

SCHEMBL25700613

CNCCC(=O)NCCSSCCNC(=O)CCC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.35
GAA P10253 1/20 0.32
CASP2 P42575 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
SLC15A2 Q16348 1/20 0.31
MEN1 O00255 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
LPAR1 Q92633 1/20 0.30
FBP1 P09467 1/20 0.30
NAAA Q02083 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
SCHEMBL16526493 0.95 LMNA (0.41) LMNAALDH1A1TSHRGAACASP2
SCHEMBL8975691 0.91 LMNA (0.46) LMNAALDH1A1TSHRCASP2CA1
SCHEMBL25700311 0.91 ALDH1A1 (0.43) LMNAALDH1A1TSHRGAACASP2
SCHEMBL15344335 0.84 FAAH (0.39) LMNAALDH1A1TSHRCASP2LPAR1
SCHEMBL26178805 0.84 CASP2 (0.40) LMNAALDH1A1TSHRGAACASP2
SCHEMBL13340981 0.82 PAOX (0.37) LMNAALDH1A1TSHRGAACASP2
SCHEMBL19381473 0.81 ALDH1A1 (0.34) LMNAALDH1A1TSHRGAACASP2
SCHEMBL19115845 0.81 ALDH1A1 (0.46) LMNAALDH1A1TSHRGAACASP2
SCHEMBL13641578 0.81 ALDH1A1 (0.39) LMNAALDH1A1TSHRGAACASP2
SCHEMBL24445178 0.79 ALDH1A1 (0.38) LMNAALDH1A1TSHRGAACASP2

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
WO-2023111290-A1 POLYSARCOSINE-VITAMIN E DERIVATIVES POLYPEPTIDE THERAPEUTIC SOLUTIONS, S.L. (ES) 2023-06-22 WO disclosed