SCHEMBL4016252

SCHEMBL4016252

CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NN)cc1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 20/20 0.78
▸ CA12 O43570 19/20 0.78
▸ CA1 P00915 13/20 0.78
▸ CA2 P00918 5/20 0.72
▸ RAB9A P51151 1/20 0.69
▸ SMN1; SMN2 Q16637 1/20 0.69
▸ SLC22A6 Q4U2R8 1/20 0.69
▸ SLC22A8 Q8TCC7 1/20 0.69
▸ ABCC2 Q92887 1/20 0.69
▸ SLC22A12 Q96S37 1/20 0.69
▸ UGT1A7 Q9HAW7 1/20 0.69
▸ SLC22A11 Q9NSA0 1/20 0.69

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
SCHEMBL16197195 0.92 CA9 (0.67) CA9CA12CA1CA2RAB9A
SCHEMBL21975646 0.88 CA9 (1.00) CA9CA12CA1CA2RAB9A
SCHEMBL4931045 0.84 CA9 (0.73) CA9CA12CA1CA2RAB9A
SCHEMBL27268243 0.82 CA9 (0.77) CA9CA12CA1CA2RAB9A
SCHEMBL13651238 0.82 CA9 (0.76) CA9CA12CA1CA2RAB9A
SCHEMBL26599943 0.82 CA9 (0.76) CA9CA12CA1CA2RAB9A
Probenecid SCHEMBL1034640 0.82 CA9 (1.00) CA9CA12CA1CA2RAB9A
Probenecid SCHEMBL3663 0.82 CA9 (1.00) CA9CA12CA1CA2RAB9A
SCHEMBL31121925 0.81 CA9 (0.75) CA9CA12CA1CA2RAB9A
SCHEMBL11877545 0.81 CA9 (0.69) CA9CA12CA1CA2RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090252013-A1 HYDRAZIDE CHELATE COMPLEX COMPOUND, OPTICAL RECORDING MEDIUM USING THE COMPOUND AND RECORDING METHOD THEREOF MITSUBISHI CHEMICAL CORPORATION (JP) 2009-10-08 — — US disclosed
EP-2050794-A1 HYDRAZIDE CHELATE COMPLEX COMPOUND, OPTICAL RECORDING MEDIUM USING THE COMPOUND AND RECORDING METHOD THEREOF Mitsubishi Chemical Corporation (JP) 2009-04-22 — — EP disclosed
EP-1125942-B1 Derivatives of 6-amino or 6-hydrazinosulfonyl-3-quinolyl phosphonic acids, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-04-09 — — EP disclosed
US-6486143-B2 NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS LES LABORATOIRES SERVIER (FR) 2002-11-26 — — US disclosed
US-20010031746-A1 6-amino- or 6-hydrazino-sulphonyl-3-quinolynyl-phosphonic acid compounds LES LABORATOIRES SERVIER (FR) 2001-10-18 — — US disclosed
EP-1125942-A1 Derivatives of 6-amino or 6-hydrazinosulfonyl-3-quinolyl phosphonic acids, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-08-22 — — EP 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 (2 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-20090252013-A1 HYDRAZIDE CHELATE COMPLEX COMPOUND, OPTICAL RECORDING MEDIUM USING THE COMPOUND AND RECORDING METHOD THEREOF KCNN2, KCNH2, KCNN1 CA9 141/4885CA12 236/4885CA1 67/4885
US-20010031746-A1 6-amino- or 6-hydrazino-sulphonyl-3-quinolynyl-phosphonic acid compounds CA6, P2RY6, FPR3 CA9 176/4885CA12 311/4885CA1 377/4885

“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.

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