SCHEMBL4454729

SCHEMBL4454729

O=C(O)C(=NO)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.68
CYP2C19 P33261 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
CES1 P23141 5/20 0.48
CES2 O00748 4/20 0.48
TSHR P16473 2/20 0.48
ALDH1A1 P00352 2/20 0.48
DAO P14920 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
POLB P06746 2/20 0.46
CA2 P00918 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
CYP3A4 P08684 2/20 0.44
MAPT P10636 2/20 0.44
CA4 P22748 2/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA9 Q16790 2/20 0.44

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
SCHEMBL11461735 1.00 GAA (0.68) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL5360093 1.00 GAA (0.68) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL189919 0.84 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL12131284 0.84 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL6060474 0.84 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL3892921 0.84 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL189920 0.84 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL4353902 0.83 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL12997589 0.83 GAA (0.65) GAACYP2C19SMN1; SMN2NPC1RAB9A
SCHEMBL28249859 0.82 CYP2C19 (0.52) GAACYP2C19SMN1; SMN2CES1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117185954-A Preparation method of (E) -2-methyl-alpha-methoxyiminophenylacetic acid methyl ester and intermediate thereof 江西天宇化工有限公司 2023-12-08 CN claimed
CN-112851546-B Preparation method of (E) -2-methyl-alpha-methoxyiminophenylacetic acid methyl ester and intermediate thereof 江西天宇化工有限公司 2023-10-03 CN claimed
CN-112851546-A Preparation method of (E) -2-methyl-alpha-methoxyimino methyl phenylacetate and intermediate thereof 江西天宇化工有限公司 2021-05-28 CN claimed
EP-0628540-B1 2-Oximino-2-phenyl-acetamides BAYER AG (DE) 1999-01-20 EP claimed
EP-4591121-A1 USE OF A METAL AND/OR METALLOID-COMPRISING KETOACIDOXIMATE AND/OR A METAL-COMPOUND-COMPRISING KETOACIDOXIMATE AS A PATTERNING AGENT PAUL SCHERRER INSTITUT (CH) 2025-07-30 EP disclosed
CN-220835569-U Device for continuously synthesizing (E) -2-methyl-alpha-oxyiminophenylacetic acid 湖北省祥珈科技有限公司 2024-04-26 CN disclosed
WO-2024061550-A1 USE OF A METAL AND/OR METALLOID-COMPRISING KETOACIDOXIMATE AND/OR A METAL-COMPOUND-COMPRISING KETOACIDOXIMATE AS A PATTERNING AGENT PAUL SCHERRER INSTITUT (CH) 2024-03-28 WO disclosed
CN-117185954-A Preparation method of (E) -2-methyl-alpha-methoxyiminophenylacetic acid methyl ester and intermediate thereof 江西天宇化工有限公司 2023-12-08 CN disclosed
CN-112851546-B Preparation method of (E) -2-methyl-alpha-methoxyiminophenylacetic acid methyl ester and intermediate thereof 江西天宇化工有限公司 2023-10-03 CN disclosed
CN-112851546-A Preparation method of (E) -2-methyl-alpha-methoxyimino methyl phenylacetate and intermediate thereof 江西天宇化工有限公司 2021-05-28 CN disclosed
US-7501513-B2 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2009-03-10 US disclosed
EP-1658081-B1 IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES 4 AZA IP NV (BE) 2007-10-24 EP disclosed
EP-0149242-A2 1-(2-Hydroxyaryl)-alcan-1-one oxime, preparation and pharmaceutical use CHEMISCHE UND PHARMAZEUTISCHE FABRIKEN FAHLBERG-LIST GmbH (DE) 1985-07-24 EP disclosed
US-4334087-A FROM AN OXIMINOHALIDE ZOECON CORPORATION (US) 1982-06-08 US disclosed
US-4278670-A TREATING BACTERIAL INFECTIONS SMITHKLINE CORPORATION (US) 1981-07-14 US disclosed
US-4208517-A Caphalosporin compounds having at position-7 an α-etherified hydroxyiminoarylacetamido group GLAXO OPERATIONS UK LIMITED (GB) 1980-06-17 US disclosed
US-4203896-A WITH MERCURIC ACETATE AND ACETIC ACID, ACIDIC HYDROLYSIS OF N-PROPENYL GROUP ELI LILLY AND COMPANY (US) 1980-05-20 US disclosed
US-4144232-A Substituted azetidin-2-one antibiotics ELI LILLY AND COMPANY (US) 1979-03-13 US disclosed
US-4007174-A Cephalosporin compounds GLAXO LABORATORIES LIMITED (EN) 1977-02-08 US disclosed
US-3969401-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC WILLIAM H. RORER, INC. (US) 1976-07-13 US disclosed