SCHEMBL8552983

SCHEMBL8552983

COC(=O)c1cnc(OC)nc1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
CYP1A2 P05177 3/20 0.43
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 2/20 0.40
DYRK1A Q13627 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL4763537 0.84 HPGD (0.54) GAACYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL840683 0.83 LMNA (0.50) GAARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL2745387 0.82 GAA (0.42) GAAKMT2ANPSR1KDM4EDYRK1A
SCHEMBL8590367 0.81 RAB9A (0.47) GAARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL4762107 0.81 NPC1 (0.47) GAACYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL21746957 0.79 NFKB1 (0.55) GAARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL1759818 0.77 MAPT (0.53) GAAMAPTNFKB1NFKB2RELA
SCHEMBL2221978 0.76 AHR (0.55) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL23604996 0.76 NPC1 (0.43) CYP1A2RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL9048646 0.73 RAB9A (0.45) GAARAB9ANPC1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024182788-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. (US) 2024-09-06 WO disclosed
EP-0790826-A4 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 1998-11-11 EP disclosed
EP-0790826-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-08-27 EP disclosed