SCHEMBL25755840

SCHEMBL25755840

C=C(C)C(=O)OCC(C)OC(=O)CCC(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.58
ALDH1A1 P00352 4/20 0.44
THRB P10828 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
CA12 O43570 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 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
SCHEMBL27653413 0.93 TSHR (0.66) TSHRALDH1A1THRBLMNA
SCHEMBL11805231 0.87 TSHR (0.58) TSHRALDH1A1THRBLMNAHTT
SCHEMBL27653412 0.87 TSHR (0.61) TSHRALDH1A1THRBLMNAMAPT
SCHEMBL12793054 0.84 TSHR (0.58) TSHRALDH1A1THRB
SCHEMBL217999 0.83 TSHR (0.61) TSHRALDH1A1THRBMGAMGAA
SCHEMBL14562330 0.83 TSHR (0.61) TSHRALDH1A1THRB
SCHEMBL8500979 0.83 TSHR (0.66) TSHRALDH1A1THRB
SCHEMBL14509184 0.81 TSHR (0.46) TSHRALDH1A1THRBLMNAMAPT
SCHEMBL31122350 0.81 TSHR (0.54) TSHRALDH1A1THRBLMNAMAPT
SCHEMBL31122351 0.81 TSHR (0.54) TSHRALDH1A1THRBLMNAMAPT

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-4201932-A1 POLYMERIZABLE COMPOSITION, POLYMER, ULTRAVIOLET SHIELDING MATERIAL, LAMINATE, COMPOUND, ULTRAVIOLET ABSORBING AGENT, AND METHOD FOR PRODUCING COMPOUND FUJIFILM Corporation (JP) 2023-06-28 EP disclosed