SCHEMBL7199740

SCHEMBL7199740

C=C(CC)C(=O)Oc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.51
TTR P02766 3/20 0.49
KCNA3 P22001 1/20 0.46
MEN1 O00255 3/20 0.44
MAPT P10636 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 2/20 0.44
PKM P14618 2/20 0.44
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ABCC4 O15439 1/20 0.44
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HSP90AA1 P07900 1/20 0.44
CHRM2 P08172 1/20 0.44
HSP90AB1 P08238 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44

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
SCHEMBL27602059 0.85 ELANE (0.56) ELANETTRKCNA3MEN1MAPT
SCHEMBL8622400 0.84 TTR (0.56) ELANETTRKCNA3MEN1MAPT
SCHEMBL6367288 0.82 ELANE (0.55) ELANETTRKCNA3MEN1MAPT
SCHEMBL27584372 0.79 ELANE (0.57) ELANETTRKCNA3MEN1MAPT
SCHEMBL11039554 0.79 ELANE (0.55) ELANETTRKCNA3MEN1MAPT
SCHEMBL11101186 0.79 TTR (0.72) ELANETTRKCNA3MEN1MAPT
SCHEMBL11110100 0.78 ELANE (0.67) ELANETTRKCNA3MEN1MAPT
SCHEMBL29019962 0.77 KCNA3 (0.51) ELANETTRKCNA3MEN1MAPT
SCHEMBL28341314 0.77 ELANE (0.57) ELANETTRKCNA3MEN1MAPT
SCHEMBL11109739 0.77 KEAP1 (0.56) ELANETTRKCNA3MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6601732-B1 Noncatalytic reaction; thermoforming trays; visible light and radiation resistance COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2003-08-05 US disclosed
EP-1037818-A1 NEW USES FOR OXYGEN SCAVENGING COMPOSITIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2000-09-27 EP disclosed
WO-1999010251-A1 NEW USES FOR OXYGEN SCAVENGING COMPOSITIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1999-03-04 WO disclosed