SCHEMBL8359002

SCHEMBL8359002

CN1C(=O)NS(=O)(=O)c2cc(Br)ccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.66
CA12 O43570 3/20 0.66
CA4 P22748 3/20 0.66
CA7 P43166 3/20 0.66
CA9 Q16790 3/20 0.66
CA1 P00915 3/20 0.62
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
BRD4 O60885 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
HBB P68871 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CASP2 P42575 1/20 0.35
APP P05067 1/20 0.34
ALPI P09923 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL16285367 0.81 CA2 (0.68) CA2CA12CA4CA7CA9
SCHEMBL16283452 0.77 CA2 (0.62) CA2CA12CA4CA7CA9
SCHEMBL6240349 0.77 CA2 (1.00) CA2CA12CA4CA7CA9
SCHEMBL6510729 0.76 CA12 (0.60) CA2CA12CA4CA7CA9
SCHEMBL16277462 0.75 TP53 (0.38) CA2CA12CA4CA7CA9
SCHEMBL4708215 0.71 MAOA (0.45) CA2CA12CA4CA7CA9
SCHEMBL16278502 0.71 CA12 (0.60) CA2CA12CA4CA7CA9
SCHEMBL16283536 0.70 PTK2 (0.34) CA2CA12CA4CA7CA9
SCHEMBL30834838 0.69 CA12 (0.62) CA2CA12CA4CA7CA9
SCHEMBL1476316 0.69 CA12 (0.62) CA2CA12CA4CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9249163-B2 PDE10a inhibitors for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV. (BE) 2016-02-02 US disclosed
US-20140364414-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes JANSSEN PHARMACEUTICA, NV (BE) 2014-12-11 US disclosed
WO-2003032999-A1 ALKYNE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2003-04-24 WO 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-20140364414-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes PDE2A, PDE3B, PDE3A CA2 721/4885CA12 3877/4885CA4 1471/4885

“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.