SCHEMBL28886809

SCHEMBL28886809

C=C(C)C(=O)OCC(O)COCCCCCCCCCCCCC

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.63
USP2 O75604 1/20 0.54
LPAR5 Q9H1C0 1/20 0.54
HTT P42858 1/20 0.53
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
PLA2G2C Q5R387 3/20 0.46
SPHK1 Q9NYA1 1/20 0.45
CES2 O00748 1/20 0.45
THRB P10828 1/20 0.44
KDM4E B2RXH2 1/20 0.42
DUSP3 P51452 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL25134171 1.00 TSHR (0.63) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL410388 0.98 TSHR (0.60) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL2713012 0.94 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL3410733 0.94 TSHR (0.52) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL15870307 0.94 TSHR (0.52) TSHRUSP2LPAR5HTTCYP1A2
Propene SCHEMBL28109918 0.93 TSHR (0.54) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL56496 0.92 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL14919779 0.91 TSHR (0.50) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL996289 0.89 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL11659781 0.89 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2

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-115327853-A Photosensitive resin composition, photoresist comprising the same, display device comprising the same, and low-temperature curing method of photosensitive resin composition 株式会社LG化学 2022-11-11 CN disclosed