SCHEMBL4624922

SCHEMBL4624922

CCCOc1cc(C)ccc1P(C(=O)c1c(C)cc(C)cc1C)C(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.39
CYP2C9 P11712 2/20 0.39
TTR P02766 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C8 P10632 1/20 0.39
CHRM1 P11229 1/20 0.39
ADRA1A P35348 1/20 0.39
PPARG P37231 1/20 0.39
HTR2B P41595 1/20 0.39
PPARA Q07869 1/20 0.39
SLCO1B3 Q9NPD5 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CISD1 Q9NZ45 1/20 0.39
SLCO1B1 Q9Y6L6 1/20 0.39
ALDH1A1 P00352 8/20 0.38
MAPT P10636 3/20 0.38
GAA P10253 2/20 0.38
MAPK1 P28482 1/20 0.38
NPBWR1 P48145 1/20 0.37

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
SCHEMBL12520349 0.85 ITGB1 (0.43) TSHRPPARGPPARAALDH1A1MAPT
SCHEMBL4624663 0.84 MAPT (0.43) TSHRSMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL1853827 0.83 ITGB1 (0.47) TSHR
SCHEMBL29424084 0.83 ITGB1 (0.47) TSHR
SCHEMBL4625104 0.82 ITGB1 (0.46) TSHR
SCHEMBL4625913 0.77 MAPK1 (0.42) TSHRSMN1; SMN2PPARGPPARATDP1
SCHEMBL4629635 0.73 FOS (0.37) SMN1; SMN2PPARGPPARAALDH1A1MAPT
SCHEMBL4625969 0.73 TSHR (0.42) TSHRSMN1; SMN2CYP2C9TTRCYP1A2
SCHEMBL29660607 0.73 TSHR (0.42) TSHRSMN1; SMN2CYP2C9TTRCYP1A2
SCHEMBL14334515 0.73 ITGB1 (0.47) TSHR

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-1215044-B1 A laser engravable flexographic printing element and a method for forming a printing plate from the element DU PONT (US) 2008-05-21 EP claimed