SCHEMBL6035930

SCHEMBL6035930

O=C(C[C@H](O)[C@H](O)CO)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
KMT2A Q03164 4/20 0.50
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPK1 P28482 3/20 0.50
HPGD P15428 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
KDM4E B2RXH2 2/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50
CES1 P23141 1/20 0.50
ALDH1A1 P00352 5/20 0.48
L3MBTL1 Q9Y468 6/20 0.47
NPC1 O15118 1/20 0.47
GSK3B P49841 2/20 0.47
PTPN1 P18031 2/20 0.47
TRPA1 O75762 1/20 0.47
HIF1A Q16665 1/20 0.47
LMNA P02545 3/20 0.46

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
SCHEMBL28817349 1.00 TSHR (0.57) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL29037388 0.83 TSHR (0.61) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL10546690 0.82 TSHR (0.59) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL6748613 0.82 TSHR (0.59) TSHRKMT2AMAPTMEN1SMN1; SMN2
Benzoic Acid SCHEMBL6269463 0.81 TSHR (0.64) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL5194137 0.80 TSHR (0.57) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL4493990 0.79 PLOD2 (0.54) KMT2AMEN1TDP1KDM4ECYP3A4
SCHEMBL1606582 0.79 TSHR (0.65) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL11455228 0.78 TSHR (0.59) TSHRKMT2AMAPTMEN1SMN1; SMN2
SCHEMBL8938798 0.77 TSHR (0.58) TSHRKMT2AMAPTMEN1SMN1; SMN2

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-20060154889-A1 Polyfluorinated nucleoside analogs and methods of use thereof THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2006-07-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060154889-A1 Polyfluorinated nucleoside analogs and methods of use thereof POLRMT, PCNA, POLL TSHR 3037/4885KMT2A 2886/4885MAPT 2715/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.