SCHEMBL9326229

SCHEMBL9326229

CC(C)(C)OC(=O)ON=O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
DGAT1 O75907 1/20 0.36
HDAC6 Q9UBN7 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
GAA P10253 1/20 0.31

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
SCHEMBL6113101 0.81 ELANE (0.42) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL28653916 0.77 ELANE (0.39) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL29121 0.76 DGAT1 (0.46) ELANEDGAT1HDAC6ALDH1A1HDAC1
SCHEMBL6308085 0.75 ELANE (0.38) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL8503697 0.75 ELANE (0.38) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL28239854 0.75 DGAT1 (0.40) ELANEDGAT1HDAC6ALDH1A1HDAC1
Ammonia Solution, Strong SCHEMBL9998492 0.74 DGAT1 (0.43) ELANEDGAT1HDAC6ALDH1A1HDAC1
Fluoride SCHEMBL2692246 0.74 DGAT1 (0.43) ELANEDGAT1HDAC6ALDH1A1HDAC1
Methyl Alcohol SCHEMBL28820308 0.74 DGAT1 (0.43) ELANEDGAT1HDAC6ALDH1A1HDAC1
Hydrogen Peroxide SCHEMBL28079587 0.74 DGAT1 (0.43) ELANEDGAT1HDAC6ALDH1A1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574046-A Method for preparing (1R,3S) -3-aminocyclopentanol hydrochloride 深圳市华先医药科技有限公司 2021-03-30 CN claimed
EP-0208641-B1 MULTI-SYNTHETIZER AND SEMI-AUTOMATIC SYNTHESIS PROCESS OF PEPTIDES IN THE SOLID PHASE CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1989-09-20 EP claimed
CN-112574046-A Method for preparing (1R,3S) -3-aminocyclopentanol hydrochloride 深圳市华先医药科技有限公司 2021-03-30 CN disclosed
CN-112574046-A Method for preparing (1R,3S) -3-aminocyclopentanol hydrochloride 深圳市华先医药科技有限公司 2021-03-30 CN disclosed
CN-101454002-B Androgen receptor modulator for the treatment of prostate cancer and androgen receptor-associated diseases UNIV CALIFORNIA 2011-06-08 CN disclosed
CN-101454002-A Androgen receptor modulator for the treatment of prostate cancer and androgen receptor-associated diseases UNIV CALIFORNIA (US) 2009-06-10 CN disclosed
US-5322961-A Analogs of desferrioxamine B and method for synthesis thereof UNIVERSITY OF FLORIDA (US) 1994-06-21 US disclosed
WO-1993009088-A1 IMPROVED METHOD FOR SYNTHESIS OF DESFERRIOXAMINE B, ANALOGS AND HOMOLOGS THEREOF UNIVERSITY OF FLORIDA (US) 1993-05-13 WO disclosed