SCHEMBL31129201

SCHEMBL31129201

Ic1ccc(-c2nnc[nH]2)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.35
MAPK13 O15264 2/20 0.33
GCGR P47871 2/20 0.33
MAPK12 P53778 2/20 0.33
MAPK11 Q15759 2/20 0.33
MAPK14 Q16539 2/20 0.33
ADORA2B P29275 1/20 0.32
APP P05067 1/20 0.32
MAP2K1 Q02750 1/20 0.30

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
SCHEMBL969435 0.78 SMN1; SMN2 (0.44) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL158909 0.78 ATM (0.39) METAP2MAPK13GCGRMAPK12MAPK11
SCHEMBL3751343 0.78 ASIC3 (0.44) METAP2
SCHEMBL4331812 0.76 LMNA (0.43) MAPK13MAPK12MAPK11MAPK14
SCHEMBL22080186 0.74 TP53 (0.44) METAP2
SCHEMBL10866586 0.74 MAPT (0.44) ADORA2BAPP
SCHEMBL13881958 0.74 NOTUM (0.44) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL1233272 0.74 KDM4E (0.32)
SCHEMBL12131262 0.72
SCHEMBL12130494 0.72

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
EP-4655301-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING Epirium Bio Inc. (US) 2025-12-03 EP disclosed
WO-2024158931-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING EPIRIUM BIO INC. (US) 2024-08-02 WO disclosed