SCHEMBL1809375

SCHEMBL1809375

NS(=O)(=O)c1ccccc1CCCC[O]

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.44
CA1 P00915 7/20 0.44
CA9 Q16790 5/20 0.44
CA6 P23280 3/20 0.44
CA12 O43570 3/20 0.44
CA4 P22748 2/20 0.44
CA5A P35218 2/20 0.44
CA7 P43166 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
CYP2C9 P11712 1/20 0.44
CA14 Q9ULX7 1/20 0.44
PTGES2 Q9H7Z7 3/20 0.40
MGLL Q99685 1/20 0.40
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
ADRB3 P13945 2/20 0.40
LDHA P00338 1/20 0.35
CDK2 P24941 1/20 0.35

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
SCHEMBL1805053 0.94 CA2 (0.45) CA2CA1CA9CA6CA12
SCHEMBL8355995 0.90 CA2 (0.48) CA2CA1CA9CA6CA12
SCHEMBL1807854 0.86 CA2 (0.48) CA2CA1CA9CA6CA12
SCHEMBL6671590 0.85 CA1 (0.44) CA2CA1CA9CA6CA12
SCHEMBL8349565 0.84 CA2 (0.54) CA2CA1CA9CA6CA12
SCHEMBL1881549 0.84 CA2 (0.50) CA2CA1CA9CA6CA12
SCHEMBL1809376 0.84 CA2 (0.50) CA2CA1CA9CA6CA12
SCHEMBL579137 0.82 LIPG (0.50) CA2MGLL
SCHEMBL578729 0.82 LIPG (0.50) CA2MGLL
SCHEMBL10801251 0.82 LIPG (0.50) CA2MGLL

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.