SCHEMBL29544846

SCHEMBL29544846

CC(=NNC(=O)OC(C)(C)C)c1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.61
▸ KMT2A Q03164 2/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ RAB9A P51151 5/20 0.57
▸ NPC1 O15118 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ ATM Q13315 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ LMNA P02545 2/20 0.55
▸ HTT P42858 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54

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
SCHEMBL20583909 1.00 GAA (0.61) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL20583911 1.00 GAA (0.61) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL10806724 0.84 RAB9A (0.55) GAAKMT2ASMN1; SMN2RAB9AL3MBTL1
SCHEMBL10805983 0.83 L3MBTL1 (0.65) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL21431899 0.82 L3MBTL1 (0.55) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL10801436 0.81 L3MBTL1 (0.54) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL20583292 0.80 GAA (0.71) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL9795955 0.80 GAA (0.71) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL9795959 0.80 GAA (0.71) GAAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL23515734 0.79 GAA (0.69) GAAKMT2ASMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114716381-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-07-08 — — CN disclosed
CN-114634447-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-06-17 — — CN disclosed
CN-114621146-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-06-14 — — CN disclosed
CN-114605327-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-06-10 — — CN disclosed
CN-114591242-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-06-07 — — CN disclosed
CN-114573510-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-06-03 — — CN disclosed
CN-108473481-B Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-04-19 — — CN disclosed
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