SCHEMBL30863579

SCHEMBL30863579

CC(C)C[C@H](NC(=O)[C@H](COC(C)(C)C)NC(=O)[C@@H](N)Cc1ccc(OC(C)(C)C)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.48
▸ CTSK P43235 1/20 0.48
▸ LTA4H P09960 1/20 0.47
▸ MME P08473 2/20 0.44
▸ NPY1R P25929 1/20 0.44
▸ NPY2R P49146 1/20 0.44
▸ NPY4R P50391 1/20 0.44
▸ ACACB O00763 1/20 0.43
▸ OPRD1 P41143 2/20 0.43
▸ FOLH1 Q04609 1/20 0.42

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
SCHEMBL29666997 0.93 LTA4H (0.54) CTSLCTSKLTA4HMMENPY1R
SCHEMBL31614446 0.92 CTSL (0.48) CTSLCTSKLTA4HMMENPY1R
SCHEMBL31400267 0.91 ACACB (0.46) CTSLCTSKMMEACACB
SCHEMBL30863604 0.88 ACACB (0.43) CTSLCTSKACACBOPRD1
SCHEMBL30202260 0.87 NPY4R (0.46) NPY1RNPY2RNPY4R
SCHEMBL29468853 0.85 GRB2 (0.43) CTSLCTSKMMEACACB
SCHEMBL30483706 0.84 GRB2 (0.49) CTSLCTSKLTA4HMME
SCHEMBL30483708 0.84 GRB2 (0.49) CTSLCTSKLTA4HMME
SCHEMBL30250661 0.84 ITGB3 (0.44) MMEACACB
SCHEMBL31510099 0.83 CTSL (0.47) CTSLCTSKLTA4HNPY1RNPY2R

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
WO-2024078588-A9 NEW USE OF PEPTIDE COMPOUND IN PREPARATION OF COMPOSITION FOR SKIN AGING REPAIR 深圳市维琪科技股份有限公司 2024-09-26 — — WO disclosed
WO-2024078588-A1 NEW USE OF PEPTIDE COMPOUND IN PREPARATION OF COMPOSITION FOR SKIN AGING REPAIR 深圳市维琪科技股份有限公司 2024-04-18 — — WO disclosed
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