SCHEMBL1807219

SCHEMBL1807219

Cc1c(CC[O])cc(S(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HIF1A Q16665 1/20 0.32
ING2 Q9H160 1/20 0.32
ALDH1A1 P00352 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
CASP6 P55212 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
SCHEMBL1803296 0.89 APEX1 (0.38) HSD17B10LMNAHPGDHIF1AALDH1A1
SCHEMBL1804101 0.89 APEX1 (0.34) LCKFYNHSD17B10LMNAALDH1A1
SCHEMBL1807222 0.86 LCK (0.32) LCKFYNHSD17B10LMNAHPGD
SCHEMBL1809348 0.86 LCK (0.34) LCKFYNHSD17B10LMNAHPGD
SCHEMBL1803301 0.85 LCK (0.32) LCKFYNHSD17B10LMNAHPGD
SCHEMBL1803303 0.85 NT5E (0.34) LCKFYNHSD17B10LMNAHPGD
SCHEMBL1809351 0.82 LCK (0.34) LCKFYNHSD17B10LMNAHPGD
SCHEMBL1804879 0.81 ALDH1A1 (0.34) LCKFYNHSD17B10ING2ALDH1A1
SCHEMBL1804876 0.81 LCK (0.33) LCKFYNHSD17B10ING2ALDH1A1
SCHEMBL5125062 0.79 LCK (0.43) LCKFYNHSD17B10LMNAING2

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 LCK 3120/4885FYN 3062/4885HSD17B10 2848/4885

“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.