SCHEMBL24929889

SCHEMBL24929889

N#Cc1ccc(-c2cnc3cc(C(=O)N4CCC(F)(F)CC4)ccn23)cn1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
KCNH2 Q12809 1/20 0.41
MKNK1 Q9BUB5 9/20 0.40
MKNK2 Q9HBH9 9/20 0.40
CYP3A4 P08684 3/20 0.40
EIF4E P06730 1/20 0.40
SCN10A Q9Y5Y9 1/20 0.40
GRIN2B Q13224 1/20 0.37
EGLN2 Q96KS0 1/20 0.37
FLT3 P36888 1/20 0.36
FGFR3 P22607 1/20 0.36
KDR P35968 1/20 0.36
ALDH1A1 P00352 1/20 0.35
PDE4B Q07343 2/20 0.35

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 0.84 HPGD (0.50) HPGDMKNK1MKNK2SCN10AFLT3
SCHEMBL30361476 0.84 HPGD (0.50) HPGDMKNK1MKNK2SCN10AFLT3
SCHEMBL30947686 0.83 HPGD (0.49) HPGDMKNK1MKNK2FGFR3KDR
SCHEMBL24929322 0.83 HPGD (0.53) HPGDMKNK1MKNK2CYP3A4EIF4E
SCHEMBL24929887 0.81 HPGD (0.46) HPGDMKNK1MKNK2FGFR3KDR
SCHEMBL30361443 0.79 HPGD (0.45) HPGDMKNK1MKNK2FGFR3
SCHEMBL24929321 0.79 HPGD (0.45) HPGDMKNK1MKNK2FGFR3
SCHEMBL24929888 0.76 HPGD (0.47) HPGDCYP3A4ALDH1A1
SCHEMBL25342736 0.76 MKNK1 (0.44) HPGDMKNK1MKNK2CYP3A4EIF4E
SCHEMBL30482612 0.76 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