SCHEMBL28710147

SCHEMBL28710147

CCCCCN1C(=O)C(=O)c2cc(OC)ccc21

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.64
ALDH1A1 P00352 5/20 0.61
ALDH2 P05091 1/20 0.61
ALDH3A1 P30838 1/20 0.61
CES1 P23141 2/20 0.59
CDC25A P30304 1/20 0.59
MAPT P10636 4/20 0.55
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
POLB P06746 3/20 0.55
CHRM5 P08912 3/20 0.55
LMNA P02545 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CASP3 P42574 1/20 0.50
CASP7 P55210 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
RCE1 Q9Y256 1/20 0.50

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
SCHEMBL3027674 0.99 PARK7 (0.63) PARK7ALDH1A1ALDH2ALDH3A1CES1
SCHEMBL17274922 0.90 PARK7 (0.69) PARK7ALDH1A1MAPTKMT2AMEN1
SCHEMBL3009244 0.89 ALDH1A1 (0.61) PARK7ALDH1A1ALDH2ALDH3A1CES1
SCHEMBL3027497 0.88 CES1 (0.62) PARK7ALDH1A1ALDH2ALDH3A1CES1
SCHEMBL29011249 0.88 PARK7 (0.63) PARK7ALDH1A1ALDH2ALDH3A1MAPT
SCHEMBL29011244 0.86 PARK7 (0.62) PARK7ALDH1A1CES1CDC25AMAPT
SCHEMBL29011262 0.86 PARK7 (0.64) PARK7ALDH1A1CES1MAPTKMT2A
SCHEMBL11150416 0.86 PARK7 (0.64) PARK7ALDH1A1MAPTKMT2AMEN1
SCHEMBL3027019 0.84 ALDH1A1 (0.55) PARK7ALDH1A1ALDH2ALDH3A1CES1
SCHEMBL6559542 0.84 PARK7 (0.64) PARK7ALDH1A1ALDH3A1MAPTKMT2A

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
CN-109456249-B Synthetic method of isatin derivative 西北师范大学 2022-03-08 CN disclosed