SCHEMBL29613261

SCHEMBL29613261

COc1ccc(-c2cccnc2C)c(C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.46
ALDH1A1 P00352 3/20 0.44
TRIM24 O15164 1/20 0.43
TYR P14679 1/20 0.43
TRIM33 Q9UPN9 1/20 0.43
NFE2L2 Q16236 4/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
KMT2A Q03164 1/20 0.41
MAOA P21397 1/20 0.40
PDE2A O00408 3/20 0.39
PDE10A Q9Y233 3/20 0.39
PDE5A O76074 1/20 0.39
PDE4A P27815 1/20 0.39
PDE11A Q9HCR9 1/20 0.39
PIP4K2A P48426 1/20 0.39
PIP4K2C Q8TBX8 1/20 0.39
SYK P43405 1/20 0.39
CYP1A2 P05177 1/20 0.38

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
SCHEMBL28732809 1.00 ERN1 (0.46) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL29464785 0.86 MAOA (0.48) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL15698829 0.80 CYP11B1 (0.44) ALDH1A1RAB9AMAOAPDE2APDE10A
SCHEMBL3677398 0.80 ERN1 (0.56) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL17178323 0.79 PDE2A (0.51) NFE2L2RAB9ANPC1PDE2APDE10A
SCHEMBL17178265 0.79 PDE2A (0.53) ALDH1A1RAB9AMEN1NPC1KMT2A
SCHEMBL20595575 0.78 HSP90AA1 (0.44) NFE2L2RAB9AMEN1KMT2APDE2A
SCHEMBL28476090 0.75 ERN1 (0.50) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL7608317 0.74 PDE2A (0.44) ERN1ALDH1A1TRIM24TYRTRIM33
SCHEMBL14840763 0.73 ERN1 (0.51) ERN1ALDH1A1TRIM24TYRTRIM33

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
CN-114466913-B Dihydro quinoline photochromic compounds 光学转变有限公司 2024-07-30 CN disclosed
EP-4034610-A1 DIHYDROQUINOLINE PHOTOCHROMIC COMPOUNDS Transitions Optical, Ltd. (IE) 2022-08-03 EP disclosed
CN-114466913-A Dihydroquinoline photochromic compounds 光学转变有限公司 2022-05-10 CN disclosed