SCHEMBL29630464

SCHEMBL29630464

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
GRB2 P62993 1/20 0.41
FNTA P49354 5/20 0.41
FNTB P49356 5/20 0.41
XIAP P98170 1/20 0.40
PGGT1B P53609 1/20 0.40
F2 P00734 2/20 0.39
SLC6A2 P23975 1/20 0.39
F10 P00742 1/20 0.39
PRSS1 P07477 1/20 0.39

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
SCHEMBL30591055 0.93 GRB2 (0.45) LMNAGRB2FNTAFNTBF2
SCHEMBL29380402 0.91 OPRM1 (0.44) LMNAGRB2SLC6A2
SCHEMBL29592632 0.90 GRB2 (0.40) GRB2SLC6A2
SCHEMBL29590979 0.90 NAA50 (0.41)
SCHEMBL30787962 0.88 GRB2 (0.45) GRB2
SCHEMBL29630429 0.87 GRB2 (0.47) GRB2FNTAFNTBXIAPF2
SCHEMBL30075945 0.86 XIAP (0.44) LMNAGRB2FNTAFNTBXIAP
SCHEMBL31171900 0.86 GRB2 (0.48) GRB2F2
SCHEMBL30185040 0.86 GRB2 (0.45) GRB2FNTAFNTBF2
SCHEMBL29591680 0.85 GRB2 (0.47) GRB2F2SLC6A2

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