SCHEMBL28070858

SCHEMBL28070858

C=CC(=O)OP(C)(=O)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 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
SCHEMBL6114142 0.75 TSHR (0.33) TSHRALDH1A1TP53CYP3A4HIF1A
SCHEMBL17830137 0.73
SCHEMBL27718211 0.72 TSHR (0.41) TSHRALDH1A1TP53CYP3A4HIF1A
SCHEMBL27927440 0.71 TSHR (0.31) TSHR
SCHEMBL28245099 0.71 TSHR (0.39) TSHRALDH1A1TP53CYP3A4HIF1A
SCHEMBL4253621 0.69
SCHEMBL28881367 0.69 TSHR (0.38) TSHRALDH1A1TP53CYP3A4MAPK1
Phosphoric Acid SCHEMBL28722148 0.68 TSHR (0.34) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL4611366 0.68 ALDH1A1 (0.32) ALDH1A1
SCHEMBL13836711 0.68

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-105584120-A Infrared reflective film NITTO DENKO CORP 2016-05-18 CN disclosed