SCHEMBL28634353

SCHEMBL28634353

CCOC(=O)c1cc2c(=O)c3ccccc3sc2cc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.49
GABRD O14764 1/20 0.49
GABRA1 P14867 1/20 0.49
GABRB1 P18505 1/20 0.49
GABRG2 P18507 1/20 0.49
GABRB3 P28472 1/20 0.49
GABRA5 P31644 1/20 0.49
GABRA3 P34903 1/20 0.49
GABRA2 P47869 1/20 0.49
GABRB2 P47870 1/20 0.49
GABRA4 P48169 1/20 0.49
GABRE P78334 1/20 0.49
GABRA6 Q16445 1/20 0.49
GABRG1 Q8N1C3 1/20 0.49
GABRG3 Q99928 1/20 0.49
GABRQ Q9UN88 1/20 0.49
ALDH1A1 P00352 8/20 0.49
HSD17B10 Q99714 4/20 0.49
MAPT P10636 5/20 0.46
RAB9A P51151 4/20 0.46

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
SCHEMBL29264067 0.85 MAPT (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29278290 0.84 MAPT (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28728284 0.84 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29279645 0.83 GABRP (0.47) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8956112 0.82 MAPT (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8980932 0.81 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10421322 0.80 ALDH1A1 (0.55) GABRA1GABRB2ALDH1A1MAPTRAB9A
SCHEMBL28628092 0.80 GABRP (0.47) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL51409 0.80 ALDH1A1 (0.58) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10989791 0.80 ALDH1A1 (0.54) GABRPGABRDGABRA1GABRB1GABRG2

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-107652222-B Oxime ester photoinitiators 巴斯夫欧洲公司 2021-09-10 CN claimed