SCHEMBL29658139

SCHEMBL29658139

C[C@@H](O)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.58
▸ ECE1 P42892 9/20 0.54
▸ IL23R Q5VWK5 1/20 0.54
▸ MAGI3 Q5TCQ9 1/20 0.53
▸ ERBB2 P04626 1/20 0.52

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
SCHEMBL31222656 0.91 ACE (0.63) ACEECE1
SCHEMBL31299590 0.89 IL23R (0.58) ACEIL23RERBB2
SCHEMBL30724706 0.88 ACE (0.62) ACEECE1
SCHEMBL31039961 0.87 MAGI3 (0.58) ACEECE1MAGI3ERBB2
SCHEMBL32667969 0.87 ERAP2 (0.60) ECE1
SCHEMBL29851151 0.86 ACE (0.57) ACEECE1MAGI3
SCHEMBL30604605 0.86 ACE (0.70) ACEECE1
SCHEMBL31299579 0.86 ERBB2 (0.58) ACEECE1IL23RMAGI3ERBB2
SCHEMBL11689314 0.85 IL23R (0.59) IL23R
SCHEMBL11691996 0.85 IL23R (0.59) IL23R

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-114478789-A anti-PD-L1 and OX40 bispecific antibodies and uses thereof 安徽安科生物工程(集团)股份有限公司 2022-05-13 — — CN disclosed
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