SCHEMBL1805282

SCHEMBL1805282

[NH]C(=O)c1cccc(S(N)(=O)=O)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.59
CA1 P00915 14/20 0.59
CA9 Q16790 8/20 0.52
CA12 O43570 7/20 0.52
CA4 P22748 3/20 0.52
CA14 Q9ULX7 3/20 0.52
CA6 P23280 3/20 0.51
CA7 P43166 3/20 0.51
CA13 Q8N1Q1 3/20 0.51
MAPT P10636 1/20 0.47
NOS1 P29475 1/20 0.46
CA3 P07451 1/20 0.45
CA5A P35218 1/20 0.45
PLA2G7 Q13093 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
STAT3 P40763 1/20 0.45

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
SCHEMBL7913940 0.84 CA1 (0.64) CA2CA1CA9CA12CA4
SCHEMBL1294641 0.82 TSHR (0.52) CA2CA1MAPT
SCHEMBL31670545 0.82 CA1 (0.67) CA2CA1CA9CA12CA4
SCHEMBL30230622 0.82 CA2 (0.61) CA2CA1CA9CA12CA4
SCHEMBL1805285 0.82 CA2 (0.61) CA2CA1CA9CA12CA4
SCHEMBL67270 0.82 CA1 (0.67) CA2CA1CA9CA12CA4
SCHEMBL10589468 0.81 CA2 (0.59) CA2CA1CA9CA12CA4
SCHEMBL3347957 0.81 CA2 (0.63) CA2CA1CA9CA12CA4
SCHEMBL6929533 0.81 CA1 (0.59) CA2CA1CA9CA12CA4
SCHEMBL9796322 0.79 CA2 (0.64) CA2CA1CA9CA12CA4

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 798/4885CA9 1071/4885

“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.