SCHEMBL1808591

SCHEMBL1808591

[O]c1c(C(=O)O)cc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 14/20 0.51
CYP2C9 P11712 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP2D6 P10635 1/20 0.50
MPL P40238 3/20 0.49
RCE1 Q9Y256 1/20 0.44
SUMO2 P61956 1/20 0.43
SUMO1 P63165 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP2 Q9HC62 1/20 0.43
SENP1 Q9P0U3 1/20 0.43
BCL2L1 Q07817 2/20 0.42

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
SCHEMBL1805256 0.85 MCL1 (0.71) MCL1CYP2C9HSD17B10BCL2L1
SCHEMBL1805693 0.85 CYP2C9 (0.43) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL4368303 0.83 MCL1 (0.51) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL1808593 0.83 MCL1 (0.73) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL7207391 0.81 SENP2 (0.56) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL1805677 0.81 TTR (0.50) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL7206515 0.81 MCL1 (0.50) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL9845555 0.81 MCL1 (0.50) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL29472291 0.77 CYP2D6 (0.50) MCL1CYP2C9HSD17B10CYP2D6MPL
SCHEMBL7190686 0.77 CYP2D6 (0.50) MCL1CYP2C9HSD17B10CYP2D6MPL

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 MCL1 3071/4885CYP2C9 692/4885HSD17B10 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.