SCHEMBL3406370

SCHEMBL3406370

CN(C(=O)c1ccc(S(N)(=O)=O)cc1)c1ccc2nc(S)sc2n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CCNA2 P20248 4/20 0.36
CDK2 P24941 4/20 0.36
CA2 P00918 12/20 0.36
CA1 P00915 9/20 0.36
CA9 Q16790 7/20 0.36
CA12 O43570 5/20 0.36
CA14 Q9ULX7 3/20 0.35
CA3 P07451 1/20 0.35
CA6 P23280 1/20 0.35
CYP2C19 P33261 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA5B Q9Y2D0 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
SCHEMBL3406734 0.87 CA2 (0.35) MAPTKDM4ENPC1RAB9ACCNA2
SCHEMBL3403261 0.86 CA1 (0.50) MAPTKDM4ENPC1RAB9ACA2
SCHEMBL3405174 0.86 GAA (0.35) MAPTKDM4ENPC1RAB9ACA2
SCHEMBL3406504 0.84 SMN1; SMN2 (0.39) MAPTKDM4ENPC1RAB9A
SCHEMBL3405694 0.84 CA2 (0.45) KDM4ERAB9ACCNA2CDK2CA2
SCHEMBL3403902 0.83 CA2 (0.34) MAPTKDM4ENPC1RAB9ACA2
SCHEMBL3406254 0.82 LMNA (0.45) KDM4ENPC1RAB9A
SCHEMBL3406797 0.81 TP53 (0.43) MAPTKDM4ENPC1RAB9ACA2
SCHEMBL3403717 0.81 GPBAR1 (0.38) MAPTNPC1RAB9A
SCHEMBL3404000 0.79 CA2 (0.39) NPC1RAB9ACA2CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370260-B1 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2010-11-24 EP claimed
US-20040092503-A1 Azoles as malonyl-coa decarboxylase inhibitors useful as metabolic modulators CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2004-05-13 US claimed
EP-1370260-A2 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-12-17 EP claimed
WO-2002066035-A2 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-08-29 WO claimed

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-20040092503-A1 Azoles as malonyl-coa decarboxylase inhibitors useful as metabolic modulators ME1, ME3, ME2 MAPT 3030/4885KDM4E 675/4885NPC1 833/4885

“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.