SCHEMBL18211783

SCHEMBL18211783

O=COCCCCCCCCCCn1cc[n+](CCCCCCCCCCC(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
HSP90AA1 P07900 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TBXAS1 P24557 3/20 0.38
FDPS P14324 15/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL18307196 0.87 MEN1 (0.49) MEN1HSP90AA1KMT2ASMN1; SMN2TBXAS1
SCHEMBL18211778 0.79 MEN1 (0.55) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL22667793 0.79 MEN1 (0.55) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL27206398 0.78 MEN1 (0.44) MEN1HSP90AA1KMT2ASMN1; SMN2TBXAS1
SCHEMBL22667804 0.78 ALDH1A1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2TBXAS1
SCHEMBL2609282 0.77 MAPT (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL18211775 0.74
SCHEMBL18211772 0.74
SCHEMBL12260134 0.73 TSHR (0.50) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL2285994 0.73 ALDH1A1 (0.56) MEN1KMT2AALDH1A1

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-20160329161-A1 CARRIER SYSTEM AND PHOTOELECTRIC CONVERSION DEVICE ADEKA CORPORATION (JP) 2016-11-10 US disclosed