SCHEMBL4672996

SCHEMBL4672996

C[C](C)C(=O)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.52
ALDH1A1 P00352 4/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 2/20 0.47
HSP90AA1 P07900 1/20 0.47
ATM Q13315 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP1A2 P05177 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.42
NSD2 O96028 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LMNA P02545 1/20 0.41

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
Diphenyl Ethanedioat SCHEMBL27942895 0.88 ELANE (0.53) ELANEALDH1A1MAPTGAAHSP90AA1
SCHEMBL9395495 0.86 ELANE (0.52) ELANEALDH1A1MAPTGAAHSP90AA1
SCHEMBL43236 0.86 ELANE (0.52) ELANEALDH1A1MAPTGAAHSP90AA1
Diphenyl Ethanedioat SCHEMBL43364 0.85 TDP1 (0.54) ELANEALDH1A1MAPTATML3MBTL1
SCHEMBL29141110 0.84 ELANE (0.46) ELANEALDH1A1MAPTGAAHSP90AA1
SCHEMBL468355 0.84 ELANE (0.50) ELANEALDH1A1MAPTGAAHSP90AA1
Ammonia Solution, Strong SCHEMBL9215530 0.84 ELANE (0.50) ELANEALDH1A1MAPTGAAHSP90AA1
SCHEMBL9218275 0.84 ELANE (0.50) ELANEALDH1A1MAPTGAAHSP90AA1
SCHEMBL9217788 0.84 ELANE (0.50) ELANEALDH1A1MAPTGAAHSP90AA1
SCHEMBL9217983 0.84 ELANE (0.50) ELANEALDH1A1MAPTGAAHSP90AA1

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
US-6221894-B1 ACARICIDAL, ANTIPARASITIC, INSECTICIDAL AND ANTHELMINTIC AGENTS. MERCK & CO., INC. 2001-04-24 US claimed
WO-2023176458-A1 DISINFECTING COMPOSITION CONTAINING THIAZOLE CARBOXYLIC ACID HYDRAZIDE COMPOUND 石原産業株式会社 2023-09-21 WO disclosed
EP-1095935-B1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL CO (JP) 2008-12-17 EP disclosed
EP-1101761-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL CO (JP) 2005-08-17 EP disclosed
US-6410484-B1 ACTIVE MATERIAL; CONTROLLING WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
US-6339155-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-15 US disclosed
EP-1101761-A2 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-23 EP disclosed
EP-1095935-A1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-02 EP disclosed