SCHEMBL23734812

SCHEMBL23734812

CCC(COC[C@@H]1CO1)(COC[C@@H]1CO1)COC[C@H]1CO1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.63
MAPK1 P28482 1/20 0.63
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 9/20 0.47
TDP1 Q9NUW8 2/20 0.47
GLA P06280 1/20 0.36
TP53 P04637 4/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HIF1A Q16665 2/20 0.34
CYP1A2 P05177 1/20 0.34
PPARG P37231 1/20 0.34
CYP3A4 P08684 2/20 0.33
THRB P10828 1/20 0.31

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
SCHEMBL36668 1.00 TSHR (0.63) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL13067061 1.00 TSHR (0.63) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL9058588 0.96 TSHR (0.63) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL16314673 0.92 TSHR (0.55) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
Bicarbonate SCHEMBL17599133 0.91 TSHR (0.53) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL14422283 0.91 TSHR (0.53) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL16576778 0.91 TSHR (0.53) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL9907091 0.91 TSHR (0.53) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL12035154 0.90 SMN1; SMN2 (0.55) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL17123506 0.89 TSHR (0.52) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1

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-3231607-B1 INTERLAYER COMPOSITION AND DEVICES MADE THEREFROM XEROX CORP (US) 2021-08-11 EP disclosed