SCHEMBL29099425

SCHEMBL29099425

CCOC(=O)N1CCCC1NC

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ GAA P10253 3/20 0.45
▸ RAB9A P51151 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ HCRTR2 O43614 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CHRM1 P11229 1/20 0.39
▸ FKBP1A P62942 2/20 0.38

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
Hydrochloric Acid SCHEMBL28670873 0.98 L3MBTL1 (0.44) THRBATML3MBTL1GAARAB9A
SCHEMBL6248598 0.85 SMN1; SMN2 (0.44) ATML3MBTL1RAB9AALDH1A1POLB
SCHEMBL20663620 0.80 DPP4 (0.40) L3MBTL1POLB
SCHEMBL13532420 0.79 RAB9A (0.43) THRBATML3MBTL1GAARAB9A
SCHEMBL12133179 0.79 RAB9A (0.43) THRBATML3MBTL1GAARAB9A
SCHEMBL15730209 0.78 RAB9A (0.45) THRBATML3MBTL1GAARAB9A
SCHEMBL9732326 0.78 RAB9A (0.45) THRBATML3MBTL1GAARAB9A
SCHEMBL15274970 0.78 RAB9A (0.45) THRBATML3MBTL1GAARAB9A
SCHEMBL2684345 0.77 HSD17B10 (0.50) ALDH1A1
SCHEMBL4244079 0.77 HSD17B10 (0.50) ALDH1A1

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
CN-111801100-B 7-substituted sulfoimidoyl purinone compounds and derivatives for the treatment and prevention of liver cancer 豪夫迈·罗氏有限公司 2023-10-24 — — CN disclosed
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