SCHEMBL9356396

SCHEMBL9356396

C=CCOC(=O)[C@H](Cc1ccccc1)N1C(=O)C=CC1=O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCL2L2 Q92843 3/20 0.54
HSD11B1 P28845 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ALDH1A1 P00352 6/20 0.43
GAA P10253 2/20 0.43
PKM P14618 2/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 1/20 0.41
AADAT Q8N5Z0 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CASP1 P29466 1/20 0.39

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
SCHEMBL10538147 0.83 BCL2L2 (0.52) BCL2L2HSD11B1NPSR1ALDH1A1GAA
SCHEMBL6997025 0.80 HSD11B1 (0.48) HSD11B1NPSR1ALDH1A1GAAPKM
SCHEMBL10536718 0.80 HSD11B1 (0.48) HSD11B1NPSR1ALDH1A1GAAPKM
SCHEMBL29017686 0.80 HSD11B1 (0.48) HSD11B1NPSR1ALDH1A1GAAPKM
SCHEMBL12205947 0.80 HSD11B1 (0.54) HSD11B1NPSR1ALDH1A1GAAPKM
SCHEMBL10536673 0.78 ALDH1A1 (0.68) NPSR1ALDH1A1GAAPKMHSD17B10
SCHEMBL9326774 0.78 ALDH1A1 (0.68) NPSR1ALDH1A1GAAPKMHSD17B10
SCHEMBL8873673 0.78 ALDH1A1 (0.68) NPSR1ALDH1A1GAAPKMHSD17B10
SCHEMBL14331820 0.76 CYP3A4 (0.51) BCL2L2NPSR1ALDH1A1PKMHSD17B10
SCHEMBL7496164 0.75 CYP3A4 (0.50) BCL2L2NPSR1ALDH1A1PKMHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6107632-A None JP disclosed
JP-6107631-A None JP disclosed
JP-6107628-A None JP disclosed
JP-H06107632-A PRODUCTION OF N-MALEOYLPHENYLALANINE ALKYL ESTER TOSOH CORP 1994-04-19 JP disclosed
JP-H06107628-A PRODUCTION OF N-@(3754/24)AMINOSUCCINYL)PHENYLALANINE ALKYL ESTER TOSOH CORP 1994-04-19 JP disclosed
JP-H06107631-A PRODUCTION OF N-MALEOYLPHENYLALANINE ALKYL ESTER TOSOH CORP 1994-04-19 JP disclosed
US-H645-H Process for the conversion of maleic acid derivatives to their corresponding fumaric isomers THE NUTRASWEET COMPANY (US) 1989-06-06 US disclosed
US-4709075-A REACTING ALKYL L-PHENYLALANATE AND MALEIC ANHYDRIDE HOECHST AKTIENGESELLSCHAFT (DE) 1987-11-24 US disclosed
US-4709075-A REACTING ALKYL L-PHENYLALANATE AND MALEIC ANHYDRIDE HOECHST AKTIENGESELLSCHAFT (DE) 1987-11-24 US disclosed
US-4709075-A REACTING ALKYL L-PHENYLALANATE AND MALEIC ANHYDRIDE HOECHST AKTIENGESELLSCHAFT (DE) 1987-11-24 US disclosed