SCHEMBL1805341

SCHEMBL1805341

Cc1ccc(C[O])cc1S(N)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.43
CA1 P00915 7/20 0.43
CA12 O43570 5/20 0.43
CA9 Q16790 5/20 0.43
BRD4 O60885 1/20 0.43
BRD2 P25440 1/20 0.43
BRD3 Q15059 1/20 0.43
MAOB P27338 1/20 0.42
PDIA6 Q15084 1/20 0.41
GLO1 Q04760 3/20 0.41
CA7 P43166 3/20 0.41
CA4 P22748 1/20 0.41
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
ESR2 Q92731 1/20 0.38

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
SCHEMBL1803955 0.85 GLO1 (0.42) CA2CA1CA12CA9BRD4
SCHEMBL1807162 0.85 PDIA6 (0.53) CA2CA1CA12CA9PDIA6
SCHEMBL28732668 0.85 CA2 (0.48) CA2CA1CA12CA9BRD4
SCHEMBL7904621 0.85 CA2 (0.52) CA2CA1CA12CA9BRD4
SCHEMBL29469901 0.85 CA2 (0.52) CA2CA1CA12CA9BRD4
SCHEMBL1805343 0.83 CA2 (0.50) CA2CA1CA12CA9BRD4
SCHEMBL27554982 0.83 CA2 (0.42) CA2CA1CA12CA9BRD4
SCHEMBL7903014 0.81 CA2 (0.55) CA2CA1CA12CA9BRD4
SCHEMBL111618 0.81 CA12 (0.52) CA2CA1CA12CA9BRD4
SCHEMBL1805731 0.81 POLB (0.55) BRD4ALDH1A1POLBRECQLESR2

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 CA2 1279/4885CA1 798/4885CA12 1243/4885

“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.