SCHEMBL23393940

SCHEMBL23393940

CN[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(N)=O)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 2/20 0.39
▸ NOD1 Q9Y239 1/20 0.37
▸ C3AR1 Q16581 1/20 0.35
▸ FURIN P09958 4/20 0.35
▸ NPY4R P50391 6/20 0.34
▸ NPY1R P25929 4/20 0.34
▸ NPY2R P49146 3/20 0.34
▸ NPY5R Q15761 3/20 0.34
▸ ECE1 P42892 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALB P02768 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TLR2 O60603 1/20 0.33

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
SCHEMBL21103418 0.93 SIRT5 (0.36) SIRT5NOD1C3AR1FURINNPY4R
SCHEMBL15499691 0.93 SIRT5 (0.36) SIRT5NOD1C3AR1FURINNPY4R
SCHEMBL20375659 0.93 SIRT5 (0.36) SIRT5NOD1C3AR1FURINNPY4R
SCHEMBL20375788 0.93 SIRT5 (0.36) SIRT5NOD1C3AR1FURINNPY4R
SCHEMBL18661755 0.93 SIRT5 (0.36) SIRT5NOD1C3AR1FURINNPY4R
SCHEMBL16091799 0.93 SIRT5 (0.36) SIRT5NOD1C3AR1FURINNPY4R
SCHEMBL20795891 0.90 FURIN (0.36) SIRT5C3AR1FURINNPY4RNPY1R
SCHEMBL21915057 0.90 C3AR1 (0.34) SIRT5C3AR1FURINSMN1; SMN2LMNA
SCHEMBL24490420 0.90 C3AR1 (0.34) SIRT5C3AR1FURINSMN1; SMN2LMNA
SCHEMBL22001947 0.90 C3AR1 (0.34) SIRT5C3AR1FURINSMN1; SMN2LMNA

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
EP-3250237-B1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY SUTRO BIOPHARMA INC (US) 2021-05-26 — — EP disclosed
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