SCHEMBL7780229

SCHEMBL7780229

CC(C)(C)C(=O)Oc1ccc(C(=O)O)c(N)c1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELANE P08246 12/20 0.58
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CA2 P00918 5/20 0.45

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
SCHEMBL4755649 0.82 ELANE (0.79) ELANEKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7468648 0.81 KDM4E (0.67) ELANEKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5510119 0.80 ELANE (0.55) ELANECA2
SCHEMBL11334017 0.79 ELANE (0.64) ELANEKDM4EALDH1A1CA2
SCHEMBL25513185 0.78 ALDH1A1 (0.71) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL147211 0.78 SMN1; SMN2 (0.54) KDM4EALDH1A1HPGD
SCHEMBL7780345 0.77 ALDH1A1 (0.51) ELANEKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7781084 0.77 ESR1 (0.49) ELANEKDM4EALDH1A1HPGDHSD17B10
SCHEMBL714478 0.77 NR4A1 (0.52) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1360931 0.77 ELANE (0.55) ELANECA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781767-B1 Process for producing isatoic anhydrides SUMITOMO CHEMICAL CO (JP) 2001-09-05 EP disclosed
US-5981749-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-11-09 US disclosed
US-5973145-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-10-26 US disclosed
US-5795984-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-08-18 US disclosed
EP-0781767-A1 Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-02 EP disclosed