SCHEMBL7198330

SCHEMBL7198330

CC=C(C)C(=O)OCC(C)(c1ccc(OCC2CO2)cc1)c1ccc(OCC2CO2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
MAPT P10636 4/20 0.54
TP53 P04637 3/20 0.54
TSHR P16473 3/20 0.54
HPGD P15428 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HIF1A Q16665 2/20 0.54
CYP1A2 P05177 1/20 0.54
PPARG P37231 1/20 0.54
LMNA P02545 3/20 0.42
PKM P14618 2/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 2/20 0.37
PARP1 P09874 1/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
CYP3A4 P08684 1/20 0.37
RAB9A P51151 5/20 0.36
NPC1 O15118 4/20 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
SCHEMBL28053643 0.80 ALDH1A1 (0.50) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL6711258 0.79 SMN1; SMN2 (0.47) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL9617214 0.78 SMN1; SMN2 (0.40) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL6707500 0.77 LMNA (0.41) ALDH1A1MAPTTSHRMEN1KMT2A
SCHEMBL7111772 0.77 ALDH1A1 (0.69) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL14881205 0.76 POLB (0.41) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL347899 0.76 ESR1 (0.45) ALDH1A1TSHRHPGDMEN1KMT2A
SCHEMBL20520300 0.75 POLB (0.46) ALDH1A1TSHRMEN1KMT2AGAA
SCHEMBL10764507 0.75 ALDH1A1 (0.62) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL7137602 0.75 TP53 (0.58) ALDH1A1MAPTTP53TSHRHPGD

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
US-6602929-B1 Reaction product of a polyether having a (meth)acryloyl group and a hydroxyl group at opposite ends with a diisocyante; Upon curing, it forms a coating having a minimized water absorption on the optical fiber SHIN-ETSU CHEMICAL CO., LTD. (JP) 2003-08-05 US disclosed