SCHEMBL25696459

SCHEMBL25696459

c1ccc(-c2nc3cnc4[nH]ccc4c3[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.48
MAPK14 Q16539 2/20 0.45
JAK2 O60674 2/20 0.45
CDK8 P49336 2/20 0.45
IKBKB O14920 1/20 0.45
CHUK O15111 1/20 0.45
DAPK3 O43293 1/20 0.45
PRKD3 O94806 1/20 0.45
MAP4K4 O95819 1/20 0.45
PAK4 O96013 1/20 0.45
CSF1R P07333 1/20 0.45
RET P07949 1/20 0.45
IGF1R P08069 1/20 0.45
FGFR1 P11362 1/20 0.45
PRKACA P17612 1/20 0.45
FLT1 P17948 1/20 0.45
LTK P29376 1/20 0.45
GRK5 P34947 1/20 0.45
KDR P35968 1/20 0.45
MAP2K2 P36507 1/20 0.45

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
SCHEMBL24642489 0.86 CHEK2 (0.47) MAPK1JAK2JAK3TNKS
SCHEMBL25697123 0.86 MAPK1 (0.50) MAPK1MAPK14KDRRPS6KA3EGFR
SCHEMBL27432231 0.84 HSD17B1 (0.44) MAPK1JAK2PARP1GAA
SCHEMBL20289959 0.83 JAK1 (0.41) MAPK1MAPK14JAK2CDK8KDR
SCHEMBL25697037 0.82 CCNT1 (0.38) MAPK1MAPK14JAK2PRKD3MAP4K4
SCHEMBL25696601 0.82 TNKS (0.46) JAK2KDRTNKSTNKS2
SCHEMBL20290060 0.82 JAK1 (0.44) MAPK1MAPK14JAK2KDRRPS6KA3
SCHEMBL25696885 0.82 MAPK1 (0.53) MAPK1JAK2JAK3TNKSPARP1
SCHEMBL25696739 0.82 NPC1 (0.49) MAPK1MAPK14JAK2CDK8IKBKB
SCHEMBL27439654 0.81 KDM4E (0.48) KDRCDK5NPC1GAARAB9A

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-4393923-A1 PYRIDO RING COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATION Yiyou Biotech (Shanghai) Co., Ltd. (CN) 2024-07-03 EP disclosed
WO-2023115327-A1 PYRIDO RING COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATION 中国药科大学 2023-06-29 WO disclosed