SCHEMBL31491328

SCHEMBL31491328

O=c1ccc2ccc(Nc3nc(Cl)nc4c3SCC4)cc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ PDE4B Q07343 10/20 0.36
▸ PDE4D Q08499 10/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ F11 P03951 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SYK P43405 1/20 0.32
▸ CA12 O43570 1/20 0.31

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
SCHEMBL31491366 0.76 KIF11 (0.39) KIF11SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL7906240 0.75 MEN1 (0.42) SMN1; SMN2NPC1RAB9AMAPTPDE4B
SCHEMBL19624259 0.75 NFKB1 (0.51) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL375687 0.75 PDE4B (0.44) SMN1; SMN2RAB9AMAPTPDE4BPDE4D
SCHEMBL31469077 0.75 SYK (0.41) SMN1; SMN2RAB9AMAPTMEN1KMT2A
SCHEMBL3938216 0.74 RHOA (0.46) NPC1RAB9AMAPTPDE4BPDE4D
SCHEMBL29056205 0.73 PDE4B (0.50) PDE4BPDE4DKDM4ESYK
SCHEMBL30542633 0.73 PDE4B (0.50) PDE4BPDE4DKDM4ESYK
SCHEMBL31469083 0.73 PDE4B (0.47) PDE4BPDE4D
SCHEMBL13211477 0.73 HPGD (0.46) SMN1; SMN2NPC1RAB9AMAPTPDE4B

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-2025067168-A1 AZA FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2025-04-03 — — WO disclosed
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