SCHEMBL1806131

SCHEMBL1806131

Cc1ccc(S(=O)(=O)O)c(C[O])c1S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RECQL P46063 2/20 0.34
POLB P06746 2/20 0.34
ESR2 Q92731 1/20 0.34
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
GLA P06280 1/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
NT5E P21589 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MYC P01106 1/20 0.33
LMNA P02545 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL1804744 0.88 ALDH1A1 (0.36) MEN1KMT2ARECQLPOLBESR2
SCHEMBL1810112 0.88 ALDH1A1 (0.40) MEN1KMT2ARECQLHPGDHSD17B10
SCHEMBL1807170 0.86 MEN1 (0.33) MEN1KMT2ARECQLPOLBESR2
SCHEMBL1806133 0.85 MEN1 (0.35) MEN1KMT2ARECQLPOLBESR2
SCHEMBL1805371 0.85 MEN1 (0.35) MEN1KMT2ARECQLPOLBESR2
SCHEMBL1805375 0.84 RECQL (0.35) MEN1KMT2ARECQLPOLBESR2
SCHEMBL1807172 0.82 KMT2A (0.33) MEN1KMT2ARECQLPOLBESR2
SCHEMBL1805840 0.77 CDC25A (0.35) KMT2APOLBALDH1A1CYP3A4SMN1; SMN2
SCHEMBL1017902 0.76 MEN1 (0.45) MEN1KMT2ARECQLPOLBESR2
SCHEMBL31261055 0.76 MEN1 (0.45) MEN1KMT2ARECQLPOLBESR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 US disclosed
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 MEN1 592/4885KMT2A 1224/4885RECQL 529/4885

“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.