SCHEMBL3500581

SCHEMBL3500581

O=C1NC(=O)c2nccnc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
GSK3B P49841 2/20 0.35
TDP2 O95551 1/20 0.35
NSD2 O96028 1/20 0.35
ABL1 P00519 1/20 0.35
PLCG1 P19174 1/20 0.35
CES1 P23141 1/20 0.35
PAX8 Q06710 1/20 0.35
RIN1 Q13671 1/20 0.35
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.35
ADK P55263 1/20 0.33
PLK4 O00444 1/20 0.32
PRKD3 O94806 1/20 0.32
MAP4K4 O95819 1/20 0.32
LCK P06239 1/20 0.32

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
SCHEMBL8871432 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL11687696 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL4121156 0.75 MAOA (0.43) ALDH1A1GSK3BTDP2NSD2ABL1
SCHEMBL43437 0.73 TDP2 (0.56) ALDH1A1GSK3BTDP2NSD2ABL1
SCHEMBL15386158 0.71 ALDH1A1 (0.35) ALDH1A1TDP2NSD2ABL1PLCG1
SCHEMBL17159951 0.69 ALDH1A1 (0.55) ALDH1A1TDP2NSD2ABL1PLCG1
SCHEMBL23794347 0.67 PPOX (0.41) ALDH1A1GSK3BABL1MEN1BLM
SCHEMBL14380284 0.67 ALDH1A1 (0.36) ALDH1A1TDP2NSD2ABL1PLCG1
SCHEMBL18050892 0.66 ALDH1A1 (0.44) ALDH1A1MEN1BLMKMT2A
SCHEMBL7754905 0.66 LMNA (0.31) ALDH1A1LMNA

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164409-B Compounds having estrogen receptor alpha degrading activity and uses thereof 冰洲石生物科技公司 2023-07-18 CN claimed
EP-3675839-B1 NOVEL COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC (US) 2023-03-01 EP claimed
CN-114249683-A Synthesis method of N-hydroxyimide compound 中国石化扬子石油化工有限公司 2022-03-29 CN claimed
US-7019026-B1 Modulators of Protein Tyrosine Phosphatases (PTPases) NOVO NORDISK A/S (DK) 2006-03-28 US claimed
EP-1214325-B1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK AS (DK) 2005-11-09 EP claimed
EP-1214325-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2002-06-19 EP claimed
WO-2001019831-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2001-03-22 WO claimed
EP-0229391-B1 PIPERIDINE DERIVATE, ITS USE AND PHARMACEUTICAL COMPOSITION CONTAINING IT Eisai Co., Ltd. (JP) 1992-07-29 EP claimed
US-5118684-A For cardiovascular disorder EISAI CO., LTD. (JP) 1992-06-02 US claimed
EP-0229391-A1 Piperidine derivate, its use and pharmaceutical composition containing it Eisai Co., Ltd. (JP) 1987-07-22 EP claimed
JP-57142984-A None JP disclosed
CN-117050002-A Novel compounds having estrogen receptor alpha degrading activity and uses thereof 冰洲石生物科技公司 2023-11-14 CN disclosed
CN-113164409-B Compounds having estrogen receptor alpha degrading activity and uses thereof 冰洲石生物科技公司 2023-07-18 CN disclosed
CN-116234803-A Combinations of estrogen receptor degrading agents and cyclin-dependent kinase inhibitors for the treatment of cancer 冰洲石生物科技公司 2023-06-06 CN disclosed
US-20210139651-A1 QUINOID CONJUGATED POLYMER AND PREPARATION METHOD AND APPLICATION THEREOF DONGGUAN UNIVERSITY OF TECHNOLOGY (CN) 2021-05-13 US disclosed
US-4849431-A ANTICHOLINESTERASE ACTIVITY EISAI CO., LTD. (JP) 1989-07-18 US disclosed
EP-0229391-A1 Piperidine derivate, its use and pharmaceutical composition containing it Eisai Co., Ltd. (JP) 1987-07-22 EP disclosed
JP-S57142984-A NOVEL 2,3-PYRAZINEDICARBOXYLIC IMIDE A HARA HIROSHI 1982-09-03 JP disclosed
US-4193979-A Sodium 3-[[[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]-amino]carbonyl]-2-pyridinecarboxylic acid and related compounds labeled with technetium-99m G. D. SEARLE & CO. (US) 1980-03-18 US disclosed
US-3960877-A PLANT GROWTH REGULATOR, WEED KILLER DEFOLIATING AGENTS THE SHERWIN-WILLIAMS COMPANY (US) 1976-06-01 US disclosed