SCHEMBL29630398

SCHEMBL29630398

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

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.47
GNPAT O15228 1/20 0.43
TGFBR1 P36897 1/20 0.42
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
ENPEP Q07075 5/20 0.39
PDCD1LG2 Q9BQ51 1/20 0.38
CD274 Q9NZQ7 1/20 0.38

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
SCHEMBL29503906 1.00 MME (0.47) MMEGNPATTGFBR1CA2CA4
SCHEMBL30193323 1.00 MME (0.47) MMEGNPATTGFBR1CA2CA4
SCHEMBL29591002 0.98 MME (0.46) MMEGNPATTGFBR1CA2CA4
SCHEMBL30782823 0.98 MME (0.46) MMEGNPATTGFBR1CA2CA4
SCHEMBL30881174 0.98 MME (0.46) MMEGNPATTGFBR1CA2CA4
SCHEMBL30886538 0.98 MME (0.46) MMEGNPATTGFBR1CA2CA4
SCHEMBL30099579 0.95 MME (0.50) MMEGNPATTGFBR1ENPEPPDCD1LG2
SCHEMBL29591607 0.95 MME (0.50) MMEGNPATTGFBR1ENPEPPDCD1LG2
SCHEMBL31064879 0.95 GNPAT (0.48) MMEGNPATTGFBR1CA2CA4
SCHEMBL29442612 0.95 MME (0.47) MMEGNPATTGFBR1CA2CA4

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 US disclosed