SCHEMBL8196191

SCHEMBL8196191

CC(N=NC(C)(C(=O)O)C1CCC1)(C(=O)O)C1CCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL9067197 0.91 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL29889579 0.78 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL1260690 0.75 KEAP1 (0.33) KEAP1NFE2L2ALDH1A1
SCHEMBL1072250 0.74 ALDH1A1 (0.33) KEAP1NFE2L2ALDH1A1
SCHEMBL7602840 0.73 KEAP1 (0.36) KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL7722028 0.71 HDAC8 (0.38) ALDH1A1
SCHEMBL29956128 0.70 GRM2 (0.47) KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL11528165 0.70 EPHX1 (0.31)
SCHEMBL22341352 0.70 ALDH1A1 (0.35) KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL11528167 0.70 EPHX1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6146789-A Battery having a visible-light or near-infrared-light curing resin as an insulating seal THREE BOND CO., LTD. (JP) 2000-11-14 US disclosed
EP-0824276-A1 Visible-light or near-infrared-light curing resin for battery-insulating seal THREE BOND CO., LTD. (JP) 1998-02-18 EP disclosed