SCHEMBL22932201

SCHEMBL22932201

O=C(Nc1cc(C(=O)O)cc(C(=O)O)c1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.65
KMT2A Q03164 3/20 0.52
FABP7 O15540 2/20 0.45
FABP5 Q01469 2/20 0.45
CASP3 P42574 2/20 0.44
GAA P10253 1/20 0.44
PKM P14618 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MDM4 O15151 1/20 0.42
TP53 P04637 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
SCHEMBL5189498 0.97 EPHX2 (0.65) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL6031887 0.92 EPHX2 (0.59) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL30089345 0.90 EPHX2 (0.73) EPHX2KMT2AL3MBTL1
SCHEMBL118921 0.90 EPHX2 (0.73) EPHX2KMT2AL3MBTL1
SCHEMBL29400630 0.90 EPHX2 (0.73) EPHX2KMT2AL3MBTL1
SCHEMBL30983396 0.89 EPHX2 (0.56) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL3799244 0.89 EPHX2 (0.56) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL29401210 0.88 EPHX2 (0.63) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL118052 0.88 EPHX2 (0.63) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL29561956 0.88 EPHX2 (0.63) EPHX2KMT2AFABP7FABP5CASP3

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-2022257979-A1 LONG-ACTING DUAL GIP/GLP-1 PEPTIDE CONJUGATES AND METHODS OF USE THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-15 WO disclosed
WO-2021021811-A2 MYOSIN DERIVED PEPTIDES AND RELATED COMPOUNDS WITH ANTICOAGULANT ACTIVITIES THE SCRIPPS RESEARCH INSTITUTE (US) 2021-02-04 WO disclosed