SCHEMBL29804572

SCHEMBL29804572

CCCCCCCCCCCCCCCC(=O)OC[C@H](O)[C@@H]1OC(=O)C(OC(=O)CCCCCCCCCCCCCCC)=C1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.80
HSPD1 P10809 1/20 0.80
HSPE1 P61604 1/20 0.80
TST Q16762 1/20 0.80
RECQL P46063 1/20 0.80
BLM P54132 1/20 0.80
TDP1 Q9NUW8 1/20 0.80
PPM1A P35813 2/20 0.48
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
DUSP3 P51452 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ENPP2 Q13822 4/20 0.45
LPAR6 P43657 1/20 0.45
LPAR1 Q92633 1/20 0.45
LPAR4 Q99677 1/20 0.45
LPAR5 Q9H1C0 1/20 0.45
LPAR2 Q9HBW0 1/20 0.45
LPAR3 Q9UBY5 1/20 0.45

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
SCHEMBL22099880 1.00 MAPT (0.80) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL1974137 1.00 MAPT (0.80) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL7805056 1.00 MAPT (0.80) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL6429749 1.00 MAPT (0.80) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL17068354 0.93 MAPT (0.77) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL1869725 0.91 MAPT (0.66) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL16950247 0.91 MAPT (0.73) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL9722188 0.91 HSPD1 (0.67) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL17541984 0.90 MAPT (0.65) MAPTHSPD1HSPE1TSTRECQL
SCHEMBL17542097 0.90 MAPT (0.65) MAPTHSPD1HSPE1TSTRECQL

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
CN-114929180-A Dental resin-modified glass ionomer compositions and kits comprising the same 登士柏西诺德公司 2022-08-19 CN disclosed