SCHEMBL6856783

SCHEMBL6856783

CC(C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NMT2 O60551 1/20 0.46
▸ NMT1 P30419 1/20 0.46
▸ TFPI P10646 1/20 0.45
▸ GRIN2D O15399 1/20 0.44
▸ GRIN3B O60391 1/20 0.44
▸ GRIN1 Q05586 1/20 0.44
▸ GRIN2A Q12879 1/20 0.44
▸ GRIN2B Q13224 1/20 0.44
▸ GRIN2C Q14957 1/20 0.44
▸ GRIN3A Q8TCU5 1/20 0.44
▸ FOLH1 Q04609 1/20 0.42
▸ TLR2 O60603 1/20 0.42
▸ OPRL1 P41146 3/20 0.41
▸ BACE1 P56817 3/20 0.40

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
SCHEMBL6856774 1.00 NMT2 (0.46) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL30720015 0.92 TFPI (0.44) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL30882784 0.90 NMT1 (0.49) NMT2NMT1TFPITLR2OPRL1
SCHEMBL29769744 0.86 NMT1 (0.54) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL10740541 0.85 NMT1 (0.50) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL10740555 0.85 NMT1 (0.50) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL30512616 0.85 FOLH1 (0.47) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL30905707 0.85 GRIN2D (0.46) NMT2NMT1TFPIGRIN2DGRIN3B
SCHEMBL31187471 0.84 FOLH1 (0.58) NMT2NMT1FOLH1BACE1
SCHEMBL29549411 0.84 FOLH1 (0.58) NMT2NMT1FOLH1TLR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4067370-A1 HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS Yu, Chongxi (US) 2022-10-05 — — EP disclosed
EP-0636179-B1 OIL-BODY PROTEINS AS CARRIERS OF HIGH-VALUE PEPTIDES IN PLANTS SEMBIOSYS GENETICS INC (CA) 2004-09-22 — — EP disclosed
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