SCHEMBL12758242

SCHEMBL12758242

CCCCCCCCOC(=O)/C(=C\C=C\N1CCOCC1)S(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ RECQL P46063 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ NPC1 O15118 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ TSHR P16473 3/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HCAR2 Q8TDS4 2/20 0.35
▸ THRB P10828 4/20 0.34
▸ THRA P10827 1/20 0.34

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
SCHEMBL19240031 0.86 ALDH1A1 (0.64) ALDH1A1GAARECQLSMN1; SMN2LMNA
SCHEMBL12758234 0.80 ALDH1A1 (0.48) ALDH1A1GAARECQLSMN1; SMN2LMNA
SCHEMBL14456204 0.75 ALDH1A1 (0.49) ALDH1A1GAARECQLLMNAPOLB
SCHEMBL19240089 0.74 ALDH1A1 (0.48) ALDH1A1GAARECQLLMNAMAPT
SCHEMBL12382057 0.73 TSHR (0.41) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL20805921 0.72 TSHR (0.45) ALDH1A1GAASMN1; SMN2NPC1MAPT
SCHEMBL12292368 0.71 TSHR (0.41) ALDH1A1GAASMN1; SMN2NPC1MAPT
SCHEMBL13609918 0.70 ALDH1A1 (0.56) ALDH1A1GAARECQLLMNAMAPT
SCHEMBL12758247 0.70 TSHR (0.40) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL14095064 0.69 ALDH1A1 (0.89) ALDH1A1GAARECQLLMNAPOLB

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
US-20110057155-A1 ULTRAVIOLET ABSORBENT COMPOSITION FUJIFILM CORPORATION (JP) 2011-03-10 — — US disclosed
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