SCHEMBL24385166

SCHEMBL24385166

CC(c1ccc(OCC2CO2)cc1)(c1ccc(OC[C@@H]2CO2)cc1)c1ccc(OC[C@@H]2CO2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.81
TSHR P16473 4/20 0.81
TP53 P04637 3/20 0.81
MAPT P10636 2/20 0.81
HPGD P15428 2/20 0.81
MEN1 O00255 2/20 0.81
KMT2A Q03164 2/20 0.81
HIF1A Q16665 2/20 0.81
CYP1A2 P05177 1/20 0.81
PPARG P37231 1/20 0.81
PKM P14618 2/20 0.60
LMNA P02545 2/20 0.60
GAA P10253 1/20 0.60
TDP1 Q9NUW8 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.53
CYP3A4 P08684 1/20 0.53
GLA P06280 1/20 0.46
GRM2 Q14416 3/20 0.43
MAPK1 P28482 1/20 0.40
FGFR1 P11362 1/20 0.39

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
SCHEMBL614315 1.00 ALDH1A1 (0.81) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL15014708 1.00 ALDH1A1 (0.81) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL30725 0.95 ALDH1A1 (0.90) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL20869690 0.95 ALDH1A1 (0.90) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL15355150 0.95 ALDH1A1 (0.90) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL15966145 0.95 ALDH1A1 (0.73) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL9617892 0.95 ALDH1A1 (0.73) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL15386739 0.95 ALDH1A1 (0.90) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL9803440 0.94 MEN1 (0.83) ALDH1A1TSHRTP53MAPTHPGD
SCHEMBL791566 0.92 ALDH1A1 (0.69) ALDH1A1TSHRTP53MAPTHPGD

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-3387056-B1 POLYCARBONATE COMPOSITIONS CONTAINING POLYGLYCIDYL ETHER COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-05-04 EP disclosed