SCHEMBL9728466

SCHEMBL9728466

O=C(CO)OS(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTR6 P50406 1/20 0.39
MAPT P10636 3/20 0.39
HSD11B1 P28845 3/20 0.39
PARL Q9H300 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PSIP1 O75475 1/20 0.39
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 2/20 0.38
HPGD P15428 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP13 P45452 1/20 0.38
MAPK1 P28482 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
SCHEMBL27746097 0.85 L3MBTL1 (0.52) TSHRSMN1; SMN2TDP1ALDH1A1KMT2A
SCHEMBL27716097 0.82 MAPT (0.41) TSHRSMN1; SMN2HTR6MAPTHSD11B1
SCHEMBL27525119 0.82 TSHR (0.40) TSHRSMN1; SMN2HTR6MAPTHSD11B1
SCHEMBL6543497 0.82 HSD11B1 (0.50) TSHRSMN1; SMN2MAPTHSD11B1PSIP1
SCHEMBL10499173 0.82 TDP1 (0.42) TSHRSMN1; SMN2HTR6MAPTHSD11B1
SCHEMBL31228950 0.81 ALDH1A1 (0.46) TSHRSMN1; SMN2MAPTHSD11B1TDP1
SCHEMBL31296580 0.81 ALDH1A1 (0.46) TSHRSMN1; SMN2MAPTHSD11B1TDP1
SCHEMBL28445921 0.81 ALDH1A1 (0.46) TSHRSMN1; SMN2MAPTHSD11B1TDP1
SCHEMBL7855586 0.81 HSD11B1 (0.53) SMN1; SMN2HSD11B1PSIP1ALDH1A1KMT2A
SCHEMBL394372 0.79 TSHR (0.44) TSHRSMN1; SMN2HTR6TDP1ALDH1A1

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-5108861-A Evaporated cuprous iodide films as transparent conductive coatings for imaging members XEROX CORPORATION (US) 1992-04-28 US disclosed