SCHEMBL38664780

SCHEMBL38664780

CCCOC(=O)[C@H](CCC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 4/20 0.54
▸ KMT2A Q03164 1/20 0.52
▸ PTPN1 P18031 3/20 0.50
▸ CASP3 P42574 2/20 0.50
▸ MDM4 O15151 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ TNF P01375 1/20 0.46

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
SCHEMBL7713440 0.94 TLR2 (0.57) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL30434908 0.94 TLR2 (0.57) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL27093960 0.92 TLR2 (0.62) TLR2KMT2APTPN1CASP3TNF
SCHEMBL27093964 0.92 TLR2 (0.62) TLR2KMT2APTPN1CASP3TNF
SCHEMBL30919288 0.91 KMT2A (0.54) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL4300738 0.91 KMT2A (0.58) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL20504185 0.91 KMT2A (0.58) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL29650664 0.91 KMT2A (0.58) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL17826082 0.89 KMT2A (0.56) TLR2KMT2APTPN1CASP3MDM4
SCHEMBL13658468 0.89 KMT2A (0.56) TLR2KMT2APTPN1CASP3MDM4

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-121181655-B Insect short neuropeptide sNPF analogues and application thereof in pests 四川轻化工大学 2026-05-19 — — CN disclosed
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