SCHEMBL24819656

SCHEMBL24819656

CC(CCCS(=O)(=O)O)c1ccc2ccccc2c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 1/20 0.49
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
HIF1A Q16665 1/20 0.43
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
MMP9 P14780 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
AOC3 Q16853 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL10232086 0.80 MMP9 (0.47) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL354251 0.80 MMP9 (0.47) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL354252 0.80 MMP9 (0.47) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL12340944 0.79 UGT2B7 (0.49) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL24818356 0.78 UGT2B7 (0.47) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL7502070 0.78 UGT2B7 (0.50) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL8019892 0.78 RIPK1 (0.44) KMT2AAOC3
SCHEMBL20193367 0.77 UGT2B7 (0.58) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL10583623 0.76 UGT2B7 (0.49) UGT2B7MEN1KMT2ACYP1A2CYP2D6
SCHEMBL10580009 0.76 UGT2B7 (0.49) UGT2B7MEN1KMT2ACYP1A2CYP2D6

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-20220412963-A1 FLUORESCENCE TAGGING OF GLYCANS AND OTHER BIOMOLECULES THROUGH REDUCTIVE AMINATION FOR ENHANCED MS SIGNALS WATERS TECHNOLOGIES CORPORATION 2022-12-29 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-20220412963-A1 FLUORESCENCE TAGGING OF GLYCANS AND OTHER BIOMOLECULES THROUGH REDUCTIVE AMINATION FOR ENHANCED MS SIGNALS FUT5, FUT6, OGT UGT2B7 210/4885MEN1 3289/4885KMT2A 2258/4885

“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.