SCHEMBL30567413

SCHEMBL30567413

N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.67
CTSC P53634 1/20 0.51
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50

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
SCHEMBL30788339 0.95 MME (0.64) MMECTSCALPIPKMPTGS1
SCHEMBL31462157 0.92 MME (0.61) MMECTSC
SCHEMBL29368174 0.92 MME (0.61) MMECTSCALPIPKMPTGS1
SCHEMBL30481168 0.92 MME (0.61) MMECTSCALPIPKMPTGS1
SCHEMBL29706544 0.92 MME (0.61) MMECTSCALPIPKMPTGS1
SCHEMBL11211282 0.92 MME (0.65) MMECTSCALPIPKMPTGS1
SCHEMBL30924826 0.92 MME (0.65) MMECTSCALPIPKMPTGS1
SCHEMBL11211279 0.92 MME (0.65) MMECTSCALPIPKMPTGS1
SCHEMBL31215125 0.91 MME (0.60) MMECTSCALPIPKMPTGS1
SCHEMBL30735714 0.91 MME (0.60) MMECTSCALPIPKMPTGS1

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-116789734-A Oligopeptide group extracted from crayfish shells, extraction method and application thereof 奇明达(北京)植物药物技术开发有限公司 2023-09-22 CN claimed
CN-116789734-A Oligopeptide group extracted from crayfish shells, extraction method and application thereof 奇明达(北京)植物药物技术开发有限公司 2023-09-22 CN disclosed