SCHEMBL25025607

SCHEMBL25025607

N/C(=N\O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.77
▸ GALR3 O60755 1/20 0.77
▸ S1PR4 O95977 1/20 0.77
▸ ALDH1A1 P00352 1/20 0.77
▸ MAPT P10636 1/20 0.77
▸ S1PR1 P21453 1/20 0.77
▸ HTT P42858 1/20 0.77
▸ RAB9A P51151 1/20 0.77
▸ PAX8 Q06710 1/20 0.77
▸ STAT6 P42226 2/20 0.76
▸ TP53 P04637 1/20 0.76
▸ HIF1A Q16665 1/20 0.76
▸ ADK P55263 15/20 0.64
▸ DOT1L Q8TEK3 4/20 0.64
▸ DPP4 P27487 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ SLC28A1 O00337 1/20 0.56
▸ MAP3K7 O43318 1/20 0.56
▸ SLC28A2 O43868 1/20 0.56
▸ GAPDH P04406 1/20 0.56

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
SCHEMBL13021287 0.88 TP53 (0.75) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL14227089 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL12284269 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL29897938 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL15107357 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL13065171 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL2786660 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL195540 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL10262607 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT
Sangivamycin SCHEMBL29639760 0.88 NPC1 (0.82) NPC1GALR3S1PR4ALDH1A1MAPT

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-2023018985-A1 NOVEL SMALL MOLECULE INHIBITORS OF PUS7 AND USES THEREOF CITY OF HOPE (US) 2023-02-16 — — WO disclosed
Send feedback