SCHEMBL9575977

SCHEMBL9575977

CC(O)(C=O)Cc1ccc(OCC(=O)OCC2CO2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.44
ALDH1A1 P00352 1/20 0.44
PPARG P37231 1/20 0.44
HIF1A Q16665 1/20 0.44
MGLL Q99685 5/20 0.42

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
SCHEMBL9575925 0.87 ALDH1A1 (0.58) TP53MAPTHPGDTSHRMEN1
SCHEMBL9575589 0.81 ALDH1A1 (0.46) TP53MAPTHPGDTSHRMEN1
SCHEMBL8678393 0.79 MAPT (0.45) TP53MAPTHPGDTSHRMEN1
SCHEMBL8539719 0.75 GAA (0.56) TP53MAPTHPGDTSHRMEN1
SCHEMBL27130998 0.71 MGLL (0.68) TP53MAPTHPGDTSHRMEN1
SCHEMBL19358241 0.71 TRIM24 (0.43) TP53MAPTHPGDTSHRALDH1A1
SCHEMBL3975354 0.70 THRA (0.38) MAPTHPGDALDH1A1
SCHEMBL11593648 0.70 ALDH1A1 (0.56) TP53MAPTHPGDTSHRMEN1
SCHEMBL10550430 0.69 PTPN7 (0.54) TP53MAPTHPGDTSHRMEN1
SCHEMBL19644362 0.69 SMN1; SMN2 (0.50) MAPTHPGDMEN1KMT2AALDH1A1

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
EP-0281941-B1 Coreactive photoinitiators CIBA GEIGY AG (CH) 1993-12-08 EP claimed