SCHEMBL4387215

SCHEMBL4387215

CC(C(=O)O)N(O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
ALOX5 P09917 1/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
PGR P06401 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
KCNH2 Q12809 1/20 0.40
PTGS2 P35354 1/20 0.39
CYP2D6 P10635 1/20 0.38
SRC P12931 1/20 0.38
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL4387218 1.00 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL942846 0.85 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL30536064 0.82 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL14463144 0.80 NPSR1 (0.44) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL502831 0.80 PTGS2 (0.45) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL93387 0.80 PTGS2 (0.45) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL157605 0.80 PTGS2 (0.45) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL755703 0.78 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL28995220 0.78 PTGS2 (0.44) ALDH1A1SMN1; SMN2NPSR1LMNATP53
SCHEMBL755702 0.78 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2NPSR1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-212432989-U P hydroxy phenyl alanine urine detection test paper box and test paper subassembly 苏州良辰生物仪器试剂有限公司 2021-01-29 CN claimed
CN-112213485-A Magnetic nano-microsphere as p-hydroxy phenylalanine urine detection reagent and preparation method thereof 南京迪安医学检验所有限公司 2021-01-12 CN claimed
CN-1193979-A Macrolide compounds NOVARTIS AG (CH) 1998-09-23 CN claimed
CN-1088083-A Cosmetic composition UNILEVER NV (NL) 1994-06-22 CN claimed
CN-109906222-B Allosteric corticotropin releasing factor receptor 1 (CRFR 1) antagonists that reduce P-TAU and improve cognition 加利福尼亚大学董事会 2023-08-01 CN disclosed
CN-115515484-A Calibration and selection of dosages, formulations and devices for intranasal administration of N-acetylcysteine using magnetic resonance spectroscopy 纽罗内泽尔公司 2022-12-23 CN disclosed
CN-114729355-A PPM1A inhibitors and methods of using the same 奎里斯公司 2022-07-08 CN disclosed
CN-107709326-B Triazolopyridines and triazolopyrimidines for reducing stress-induced P-TAU 巴克老龄问题研究所 2021-12-17 CN disclosed
CN-109371095-B Method for synthesizing amoxicillin by enzyme method 广州市力鑫药业有限公司 2021-08-20 CN disclosed
CN-212514284-U P-hydroxy phenylalanine urine detection test paper box and test paper assembly 苏州良辰生物仪器试剂有限公司 2021-02-09 CN disclosed
CN-212432989-U P hydroxy phenyl alanine urine detection test paper box and test paper subassembly 苏州良辰生物仪器试剂有限公司 2021-01-29 CN disclosed
CN-212432989-U P hydroxy phenyl alanine urine detection test paper box and test paper subassembly 苏州良辰生物仪器试剂有限公司 2021-01-29 CN disclosed
CN-1193979-A Macrolide compounds NOVARTIS AG (CH) 1998-09-23 CN disclosed
CN-1189619-A Cancer uroscopy colorimetric method and device FU MINGONG (CN) 1998-08-05 CN disclosed
CN-1088083-A Cosmetic composition UNILEVER NV (NL) 1994-06-22 CN disclosed
EP-0594645-A1 PROCESS FOR THE PREPARATION OF PURE ISOMERIC FORMS OF 3,3,5-TRIMETHYL CYCLOHEXANOL AND 3,3,5-TRIMETHYL CYCLOHEXANONE AMINO ACID ESTERS PANMEDICA (FR) 1994-05-04 EP disclosed
WO-1992022529-A1 PROCESS FOR THE PREPARATION OF PURE ISOMERIC FORMS OF 3,3,5-TRIMETHYL CYCLOHEXANOL AND 3,3,5-TRIMETHYL CYCLOHEXANONE AMINO ACID ESTERS PANMEDICA (FR) 1992-12-23 WO disclosed
EP-0261017-B1 AMINO ACID ESTERS OF CYCLOALIPHATIC ALCOHOLS, PROCESS FOR THEIR PREPARATION AND USE AS MEDICINE PANMEDICA S.A. (FR) 1991-03-20 EP disclosed
EP-0261017-A1 Amino acid esters of cycloaliphatic alcohols, process for their preparation and use as medicine PANMEDICA S.A. (FR) 1988-03-23 EP disclosed
US-3725470-A AMINO ACID DERIVATIVES HOFFMANN LA ROCHE 1973-04-03 US disclosed