SCHEMBL30659524

SCHEMBL30659524

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.56
▸ DPP8 Q6V1X1 1/20 0.56
▸ DPP9 Q86TI2 1/20 0.56
▸ FOLH1 Q04609 7/20 0.51
▸ NAALAD2 Q9Y3Q0 2/20 0.51
▸ RIMKLA Q8IXN7 1/20 0.51
▸ BACE1 P56817 6/20 0.48
▸ GRM8 O00222 1/20 0.47
▸ GRM6 O15303 1/20 0.47
▸ GRIN2D O15399 1/20 0.47
▸ GRIN3B O60391 1/20 0.47
▸ GSR P00390 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ GRIK1 P39086 1/20 0.47
▸ GRM5 P41594 1/20 0.47
▸ GRIA1 P42261 1/20 0.47
▸ GRIA2 P42262 1/20 0.47
▸ GRIA3 P42263 1/20 0.47
▸ SLC1A3 P43003 1/20 0.47
▸ SLC1A2 P43004 1/20 0.47

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
SCHEMBL30193395 1.00 DPP4 (0.56) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL34464998 0.94 DPP4 (0.51) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL9544381 0.91 DPP4 (0.54) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL9544389 0.91 DPP4 (0.54) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL29777789 0.91 DPP4 (0.54) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL29873723 0.91 FOLH1 (0.49) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL30905101 0.91 DPP4 (0.54) DPP4DPP8DPP9BACE1GRM8
SCHEMBL30712163 0.91 DPP4 (0.54) DPP4DPP8DPP9FOLH1NAALAD2
SCHEMBL29843968 0.91 DPP4 (0.54) DPP4DPP8DPP9BACE1GRM8
SCHEMBL435319 0.90 FOLH1 (0.62) DPP4DPP8DPP9FOLH1NAALAD2

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
CN-116920086-A Nanobody-rhamnolipid conjugate and preparation method and application thereof 江南大学 2023-10-24 — — CN claimed
CN-116920086-A Nanobody-rhamnolipid conjugate and preparation method and application thereof 江南大学 2023-10-24 — — CN disclosed
Send feedback