SCHEMBL31374735

SCHEMBL31374735

CC(C)(C)OC(=O)N([C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)O)C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 6/20 0.55
▸ MAPT P10636 1/20 0.51
▸ CPB1 P15086 1/20 0.51
▸ CPB2 Q96IY4 1/20 0.51
▸ KLK7 P49862 2/20 0.51
▸ KLK5 Q9Y337 2/20 0.51
▸ TPSAB1 Q15661 2/20 0.49
▸ TPSD1 Q9BZJ3 2/20 0.49
▸ TPSG1 Q9NRR2 2/20 0.49
▸ SIRT2 Q8IXJ6 1/20 0.48
▸ SIRT1 Q96EB6 1/20 0.48
▸ MMP2 P08253 1/20 0.48
▸ MMP9 P14780 1/20 0.48

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
SCHEMBL31374694 0.85 ECE1 (0.46) CPB1CPB2
SCHEMBL7316805 0.82 MAPT (0.64) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL2334319 0.82 MAPT (0.68) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL2334326 0.82 MAPT (0.68) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL3210903 0.82 MAPT (0.68) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL17039853 0.82 FOLH1 (0.57) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL31374739 0.81 FOLH1 (0.57) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL17039826 0.81 FOLH1 (0.60) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL699636 0.80 FOLH1 (0.65) FOLH1MAPTCPB1CPB2KLK7
SCHEMBL2467817 0.80 FOLH1 (0.65) FOLH1MAPTCPB1CPB2KLK7

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
CN-113301920-B Complexes comprising a ligand, a spacer, a peptide linker and a biomolecule 安斯泰来制药株式会社 2025-01-14 — — CN disclosed
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