SCHEMBL1697489

SCHEMBL1697489

O=C(O)C(=O)c1ccc2ccccc2c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.79
CES1 P23141 1/20 0.79
SMN1; SMN2 Q16637 4/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
MAPT P10636 3/20 0.55
KDM4E B2RXH2 2/20 0.55
HPGD P15428 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
MAPK1 P28482 2/20 0.55
ALDH1A1 P00352 2/20 0.55
EGFR P00533 1/20 0.55
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
PKM P14618 1/20 0.55
ALOX15 P16050 1/20 0.55
ALOX12 P18054 1/20 0.55
JAK1 P23458 1/20 0.55
HSD17B10 Q99714 1/20 0.55
PTPN1 P18031 1/20 0.55

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
SCHEMBL547682 0.94 CES2 (0.69) CES2CES1SMN1; SMN2MEN1KMT2A
SCHEMBL31032483 0.89 CES2 (1.00) CES2CES1SMN1; SMN2MEN1KMT2A
SCHEMBL7220072 0.89 CES2 (1.00) CES2CES1SMN1; SMN2MEN1KMT2A
SCHEMBL30161362 0.87 CES2 (0.87) CES2CES1SMN1; SMN2MEN1KMT2A
SCHEMBL14876982 0.87 CES2 (0.87) CES2CES1SMN1; SMN2MEN1KMT2A
SCHEMBL31474564 0.84 CES2 (0.83) CES2CES1SMN1; SMN2MEN1KMT2A
Beta-Naphtoic Acid SCHEMBL30678322 0.82 CES2 (0.71) CES2CES1SMN1; SMN2MEN1KMT2A
Beta-Naphtoic Acid SCHEMBL30678321 0.82 CES2 (0.71) CES2CES1SMN1; SMN2MEN1KMT2A
Beta-Naphtoic Acid SCHEMBL98296 0.82 CES2 (0.71) CES2CES1SMN1; SMN2MEN1KMT2A
Beta-Naphtoic Acid SCHEMBL29628843 0.82 CES2 (0.71) CES2CES1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117844773-B Phenylalanine dehydrogenase mutant and application thereof in synthesis of L-unnatural amino acid 江南大学 2024-11-15 CN claimed
CN-117844773-A Phenylalanine dehydrogenase mutant and application thereof in synthesis of L-unnatural amino acid 江南大学 2024-04-09 CN claimed
CN-111978201-B Synthesis method of N, N' -diaryl benzoyl hydrazine compound 甘肃农业大学 2023-01-03 CN claimed
CN-111978201-A Synthesis method of N, N' -diaryl benzoyl hydrazine compound 甘肃农业大学 2020-11-24 CN claimed
CN-111056890-A Method for preparing aryl ketone by free radical-free radical coupling reaction of ketoacid decarboxylation and fatty aldehyde decarbonylation based on iron catalysis 湘潭大学 2020-04-24 CN claimed
CN-104961714-A Synthetic method of alpha,beta-unsaturated butyrolactone UNIV SOOCHOW 2015-10-07 CN claimed
JP-2002514184-A 2002-05-14 JP claimed
EP-1005348-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 2000-06-07 EP claimed
WO-1998013046-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO claimed
WO-2026100697-A1 PHOTOCURABLE EPISULFIDE COMPOSITION, CURED PRODUCT, LAMINATE, AND METHOD FOR PRODUCING CURED PRODUCT 三井化学株式会社 2026-05-15 WO disclosed
WO-2025068119-A1 PHOTOINITIATORS FOR PHOTOCURABLE COMPOSITIONS COVESTRO (NETHERLANDS) B.V. (NL) 2025-04-03 WO disclosed
WO-2025068116-A1 PHOTOINITIATORS FOR PHOTOCURABLE COMPOSITIONS COVESTRO (NETHERLANDS) B.V. (NL) 2025-04-03 WO disclosed
CN-117844773-B Phenylalanine dehydrogenase mutant and application thereof in synthesis of L-unnatural amino acid 江南大学 2024-11-15 CN disclosed
CN-117844773-B Phenylalanine dehydrogenase mutant and application thereof in synthesis of L-unnatural amino acid 江南大学 2024-11-15 CN disclosed
WO-2007030967-A1 6-METHOXY-2,6-DIMETHYLOCTANAL AND ITS USE AS A FRAGRANCE INGREDIENT GIVAUDAN SA (CH) 2007-03-22 WO disclosed
EP-0057422-B1 NEW CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-10-12 EP disclosed
EP-0191507-A2 New 2-oxyimino-3-oxobutyric acid derivatives and process for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-08-20 EP disclosed
US-4562176-A ANALOGS OF ACTINOMYCIN D NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 1985-12-31 US disclosed
US-4452851-A BACTERICIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-06-05 US disclosed
EP-0057422-A2 New cephem compounds, processes for preparation thereof and pharmaceutical composition containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-08-11 EP disclosed