SCHEMBL29435136

SCHEMBL29435136

Cc1ccc2c(c1)C(=O)c1c(O)cccc1C2=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.69
ALDH1A1 P00352 4/20 0.69
MAPT P10636 4/20 0.69
MAPK1 P28482 4/20 0.69
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
TDP1 Q9NUW8 3/20 0.69
KDM4E B2RXH2 3/20 0.69
CYP3A4 P08684 3/20 0.69
RECQL P46063 3/20 0.69
TSHR P16473 2/20 0.69
USP2 O75604 1/20 0.69
BRCA1 P38398 1/20 0.69
LCK P06239 1/20 0.67
MAOA P21397 5/20 0.63
TTR P02766 1/20 0.63
MAOB P27338 3/20 0.61
HPGD P15428 3/20 0.61
ALOX15 P16050 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61

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
SCHEMBL5981382 1.00 ELANE (0.69) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL29405931 1.00 ELANE (0.69) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL30610009 1.00 ELANE (0.69) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL375798 0.84 LCK (0.67) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL31265528 0.84 LCK (0.67) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL19461856 0.83 ALDH1A1 (0.90) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL31560165 0.83 MAOA (0.68) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL2770562 0.83 MAOA (0.68) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL6761959 0.83 ELANE (0.69) ELANEALDH1A1MAPTMAPK1MEN1
SCHEMBL2770797 0.83 MAOA (0.68) ELANEALDH1A1MAPTMAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022051842-A1 TERAHERTZ IMAGING SYSTEM WITH EVANESCENT-WAVE COUPLING INSTITUT NATIONAL D'OPTIQUE (CA) 2022-03-17 WO disclosed