SCHEMBL11599334

SCHEMBL11599334

CCCCC(=O)ONC=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.42
CES1 P23141 2/20 0.41
CES2 O00748 1/20 0.41
DGKA P23743 1/20 0.41
CNR1 P21554 1/20 0.41
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
POLA1 P09884 1/20 0.38
HSP90AA1 P07900 1/20 0.38
PAM P19021 2/20 0.37
ADH1B P00325 1/20 0.37
ADH1C P00326 1/20 0.37
ADH1A P07327 1/20 0.37
ADH7 P40394 1/20 0.37
CA1 P00915 1/20 0.37
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL991447 0.94 CNR2 (0.49) CNR2CES1CES2DGKACNR1
SCHEMBL27482958 0.92 DGKA (0.52) CNR2CES1CES2DGKATSHR
SCHEMBL29199661 0.92 DGKA (0.52) CNR2CES1CES2DGKATSHR
SCHEMBL28360017 0.92 DGKA (0.52) CNR2CES1CES2DGKATSHR
SCHEMBL29169676 0.92 DGKA (0.52) CNR2CES1CES2DGKATSHR
SCHEMBL27700699 0.92 DGKA (0.52) CNR2CES1CES2DGKATSHR
Hydrochloric Acid SCHEMBL28914870 0.90 CNR2 (0.50) CNR2CES1CES2DGKATSHR
SCHEMBL28148318 0.87
SCHEMBL28165411 0.87 TSHR (0.46) CNR2CNR1TSHRLMNAALDH1A1
SCHEMBL10699569 0.85 LMNA (0.41) CNR2DGKATSHRLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106854166-B Method for preparing octanoyl hydroxamic acid from hydroxylamine sulfate and calcium oxide 禹城禹圳生物科技有限公司 2020-11-10 CN disclosed
CN-106854166-A A kind of method that hydroxylamine sulfate and calcium oxide prepare caprylhydroxamic acid 禹城禹圳生物科技有限公司 2017-06-16 CN disclosed
CN-1168702-C Movel acyl pseudodipeoptides, prepn method and pharmaceutical compsns. contg. same OMҩҵ 2004-09-29 CN disclosed
CN-1306504-A Movel acyl pseudodipeoptides, prepn method and pharmaceutical compsns. contg. same OM PHARMA (CH) 2001-08-01 CN disclosed
US-4088688-A OXIDIZING DESOXYHUMOLONES TO OBTAIN NOVEL HYDROPEROXIDES, REDUCING GIVAUDAN CORPORATION (US) 1978-05-09 US disclosed
US-4012447-A Hydroperoxy-desoxyhumulones GIVAUDAN CORPORATION (US) 1977-03-15 US disclosed