SCHEMBL9575589

SCHEMBL9575589

CC(O)(C=O)Cc1ccc(OCCOCC2CO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
TSHR P16473 4/20 0.46
MAPT P10636 3/20 0.46
TP53 P04637 2/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
PPARG P37231 1/20 0.46
HIF1A Q16665 1/20 0.46
LMNA P02545 4/20 0.37
PKM P14618 2/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
ACACB O00763 2/20 0.34
MAPK1 P28482 1/20 0.34
PPARA Q07869 1/20 0.34
KDM4E B2RXH2 2/20 0.33
GLA P06280 1/20 0.33

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 0.89 ALDH1A1 (0.58) ALDH1A1TSHRMAPTTP53HPGD
SCHEMBL9575977 0.81 TP53 (0.44) ALDH1A1TSHRMAPTTP53HPGD
SCHEMBL10455828 0.81 LMNA (0.39) ALDH1A1TSHRMAPTHPGDMEN1
SCHEMBL194570 0.78 ALDH1A1 (0.74) ALDH1A1TSHRMAPTTP53HPGD
SCHEMBL9575718 0.78 ALDH1A1 (0.39) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL10454958 0.78 SMN1; SMN2 (0.46) ALDH1A1KMT2APPARGLMNAGAA
SCHEMBL9325190 0.77 TDP1 (0.55) ALDH1A1TSHRMAPTTP53HPGD
SCHEMBL2444784 0.77 MAPT (0.46) ALDH1A1TSHRMAPTTP53HPGD
SCHEMBL788296 0.76 SMN1; SMN2 (0.50) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL19644362 0.76 SMN1; SMN2 (0.50) ALDH1A1MAPTHPGDMEN1KMT2A

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