SCHEMBL7284372

SCHEMBL7284372

CNC(=O)[C@@](C)(NC(=O)OC(C)(C)C)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HSD17B10 Q99714 2/20 0.47
PGR P06401 1/20 0.47
PTGS1 P23219 1/20 0.47
MAPK1 P28482 1/20 0.47
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PLK1 P53350 1/20 0.40
KDM4E B2RXH2 3/20 0.40
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
NQO2 P16083 1/20 0.39
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
SSTR4 P31391 2/20 0.37
KDM4A O75164 1/20 0.36
AAK1 Q2M2I8 1/20 0.36

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
SCHEMBL6139046 0.88 ALDH1A1 (0.44) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL6375660 0.86 ALDH1A1 (0.48) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL3004207 0.86 ALDH1A1 (0.48) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL1748476 0.86 ALDH1A1 (0.48) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL4262988 0.78 MEN1 (0.43) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL3390209 0.75 MAPT (0.43) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL7275618 0.73 PLK1 (0.47) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL9514094 0.73 ALDH1A1 (0.40) GAAALDH1A1HSD17B10PGRPTGS1
SCHEMBL28546281 0.72 KDM4E (0.45) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL27702983 0.72 KDM4E (0.45) ALDH1A1HSD17B10MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5252560-A Cyclic imide derivatives, compositions and use GLAXO INC. (US) 1993-10-12 US disclosed
EP-0520573-A1 Cyclic imide derivatives GLAXO INC. (US) 1992-12-30 EP disclosed