SCHEMBL24929322

SCHEMBL24929322

O=C(O)c1ccc(-c2cnc3cc(C(=O)N4CCC(F)(F)CC4)ccn23)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.53
MKNK1 Q9BUB5 13/20 0.50
MKNK2 Q9HBH9 13/20 0.50
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
JAK3 P52333 1/20 0.41
KDR P35968 3/20 0.41
FLT3 P36888 1/20 0.40
CYP3A4 P08684 1/20 0.39
EIF4E P06730 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
SCHEMBL24929319 0.89 HPGD (0.50) HPGDMKNK1MKNK2JAK2JAK1
SCHEMBL30361476 0.89 HPGD (0.50) HPGDMKNK1MKNK2JAK2JAK1
SCHEMBL30947686 0.84 HPGD (0.49) HPGDMKNK1MKNK2JAK2JAK1
SCHEMBL24929889 0.83 HPGD (0.48) HPGDMKNK1MKNK2KDRFLT3
SCHEMBL24929887 0.80 HPGD (0.46) HPGDMKNK1MKNK2JAK2JAK1
SCHEMBL24929888 0.80 HPGD (0.47) HPGDCYP3A4
SCHEMBL30361443 0.79 HPGD (0.45) HPGDMKNK1MKNK2
SCHEMBL24929321 0.79 HPGD (0.45) HPGDMKNK1MKNK2
SCHEMBL28883063 0.74 HPGD (0.50) HPGD
SCHEMBL25342736 0.73 MKNK1 (0.44) HPGDMKNK1MKNK2CYP3A4EIF4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201926-A Bicyclic PGDH inhibitors and methods of making and using the same 埃皮里姆生物股份有限公司 2024-06-14 CN disclosed
EP-4377314-A1 BICYCLIC PGDH INHIBITORS AND METHODS OF MAKING AND USING Epirium Bio Inc. (US) 2024-06-05 EP disclosed
WO-2023009618-A1 BICYCLIC PGDH INHIBITORS AND METHODS OF MAKING AND USING EPIRIUM BIO, INC. (US) 2023-02-02 WO disclosed
WO-2023009618-A1 BICYCLIC PGDH INHIBITORS AND METHODS OF MAKING AND USING EPIRIUM BIO, INC. (US) 2023-02-02 WO disclosed