SCHEMBL25857239

SCHEMBL25857239

Cc1nnc(Cl)c2ccncc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
RAB9A P51151 2/20 0.35
IMPDH2 P12268 1/20 0.35
CHUK O15111 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 2/20 0.33
GFER P55789 1/20 0.33
ACHE P22303 1/20 0.33
POLB P06746 3/20 0.33
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GOT1 P17174 1/20 0.32
AXL P30530 1/20 0.32
EP300 Q09472 1/20 0.32
KAT2B Q92831 1/20 0.32
KAT8 Q9H7Z6 1/20 0.32
PDE2A O00408 1/20 0.32
HPGD P15428 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL793650 0.85 IMPDH2 (0.41) MAPTRAB9AIMPDH2CHUKMEN1
SCHEMBL31468033 0.85 IMPDH2 (0.41) MAPTRAB9AIMPDH2CHUKMEN1
SCHEMBL16274529 0.85 POLB (0.41) MAPTRAB9ACHUKMEN1KMT2A
SCHEMBL30502565 0.76 KDM4E (0.43) IMPDH2GAAACHEPOLBL3MBTL1
SCHEMBL24575364 0.76 IMPDH2 (0.43) MAPTRAB9AIMPDH2CHUKGAA
SCHEMBL30771962 0.76 IMPDH2 (0.43) MAPTRAB9AIMPDH2CHUKGAA
SCHEMBL3393453 0.76 ALDH1A1 (0.44) MAPTRAB9AIMPDH2CHUKMEN1
SCHEMBL25857309 0.76 FLT1 (0.43) MAPTRAB9AIMPDH2CHUKMEN1
SCHEMBL30645164 0.74 MEN1 (0.50) MAPTRAB9AMEN1KMT2AGFER
SCHEMBL2306302 0.74 MEN1 (0.50) MAPTRAB9AMEN1KMT2AGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023131277-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF 药捷安康(南京)科技股份有限公司 2023-07-13 WO disclosed