SCHEMBL28610965

SCHEMBL28610965

CC(C)(C)OC(=O)CNc1ccccc1O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 6/20 0.45
▸ HTT P42858 3/20 0.45
▸ PTPRC P08575 2/20 0.43
▸ MAPT P10636 6/20 0.41
▸ LMNA P02545 2/20 0.41
▸ THRB P10828 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ MAPK1 P28482 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ LIPG Q9Y5X9 1/20 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
SCHEMBL6437790 0.84 MAPT (0.47) GAAHTTPTPRCMAPTTDP1
SCHEMBL6902818 0.83 MAPT (0.45) GAAHTTMAPTLMNATHRB
SCHEMBL29926763 0.83 MAPT (0.45) GAAHTTMAPTLMNATHRB
SCHEMBL9135679 0.83 ALDH1A1 (0.47) PTPRCLMNATHRBTDP1KDM4E
SCHEMBL9134842 0.83 HTT (0.46) HTTPTPRCLMNATHRBTDP1
SCHEMBL5549639 0.83 PTPRC (0.42) PTPRCTHRBTDP1ALDH1A1MAPK1
SCHEMBL9134208 0.83 L3MBTL1 (0.43) HTTPTPRCMAPTLMNAKMT2A
SCHEMBL948953 0.83 ALDH1A1 (0.51) GAAHTTPTPRCMAPTLMNA
Hydrochloric Acid SCHEMBL6990475 0.81 MAPT (0.44) GAAHTTMAPTLMNATHRB
SCHEMBL9134040 0.81 GAA (0.49) GAAMAPTLMNATHRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117700372-A Preparation method of 2-substituted benzoxazole compound 西安向阳航天材料股份有限公司 2024-03-15 — — CN disclosed
CN-112480020-B 2-substituted benzoxazole compound 东华理工大学 2023-10-10 — — CN disclosed
CN-113818033-B Electrochemical synthesis method of 2-substituted benzoxazole derivative 诚达药业股份有限公司 2022-10-14 — — CN disclosed
CN-113818033-A Electrochemical synthesis method of 2-substituted benzoxazole derivative 诚达药业股份有限公司 2021-12-21 — — CN disclosed
CN-112480020-A 2-substituted benzoxazole compound 东华理工大学 2021-03-12 — — CN disclosed
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