SCHEMBL30951013

SCHEMBL30951013

CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 15/20 0.44
▸ CTSD P07339 3/20 0.43
▸ TFPI P10646 1/20 0.41
▸ NPY5R Q15761 3/20 0.40
▸ NPY1R P25929 2/20 0.40
▸ NPY4R P50391 2/20 0.40
▸ BACE2 Q9Y5Z0 1/20 0.39

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
SCHEMBL30951004 0.91 ENPEP (0.43) BACE1CTSDNPY5RNPY1RNPY4R
SCHEMBL30262234 0.88 TFPI (0.53) BACE1CTSDTFPI
SCHEMBL30140864 0.88 BACE1 (0.43) BACE1CTSDTFPINPY5RNPY1R
SCHEMBL29680161 0.87 NPY5R (0.47) BACE1TFPINPY5RNPY1RNPY4R
SCHEMBL29774714 0.86 GNPAT (0.46) NPY5RNPY1RNPY4R
SCHEMBL22546298 0.86 NPY4R (0.44) NPY5RNPY1RNPY4R
SCHEMBL29625407 0.86 GNPAT (0.46) NPY5RNPY1RNPY4R
SCHEMBL29407224 0.86 NPY4R (0.45) BACE1CTSDNPY5RNPY1RNPY4R
SCHEMBL30905096 0.86 BACE1 (0.45) BACE1CTSDNPY5RNPY1RNPY4R
SCHEMBL31571459 0.85 NPY4R (0.44) BACE1NPY5RNPY1RNPY4R

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-118063546-A Polypeptide hLFT-68, application thereof, medicine, related external dressing or skin care product 中国科学院大连化学物理研究所 2024-05-24 — — CN disclosed
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