SCHEMBL11213546

SCHEMBL11213546

CCOc1nc(OCC2CO2)nc(OCC2CO2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
TSHR P16473 6/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GLA P06280 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
TP53 P04637 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HIF1A Q16665 2/20 0.40
CYP3A4 P08684 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
CYP1A2 P05177 2/20 0.40
MAPK1 P28482 2/20 0.40
PPARG P37231 1/20 0.40
PKM P14618 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
POLB P06746 1/20 0.34

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
SCHEMBL487480 0.89 TDP1 (0.48) ALDH1A1TSHRGLATDP1TP53
SCHEMBL29397562 0.89 TDP1 (0.48) ALDH1A1TSHRGLATDP1TP53
SCHEMBL29398866 0.89 TDP1 (0.48) ALDH1A1TSHRGLATDP1TP53
SCHEMBL26752852 0.84 ALDH1A1 (0.46) ALDH1A1TSHRL3MBTL1GLATDP1
SCHEMBL3677603 0.82 TDP1 (0.42) ALDH1A1TSHRGLATDP1TP53
SCHEMBL48796 0.80 TDP1 (0.41) ALDH1A1TSHRGLATDP1TP53
SCHEMBL12747113 0.78 TDP1 (0.40) ALDH1A1TSHRGLATDP1TP53
SCHEMBL10963909 0.78 TSHR (0.42) ALDH1A1TSHRGLATDP1TP53
SCHEMBL16880542 0.78 TDP1 (0.42) ALDH1A1TSHRGLATDP1TP53
SCHEMBL27489779 0.78 TDP1 (0.47) ALDH1A1TSHRGLATDP1TP53

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-0019113-B1 AROMATIC POLYAMIDE PAPER-LIKE SHEET AND PROCESSES FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 1983-04-13 EP claimed