SCHEMBL6324792

SCHEMBL6324792

CN1C(=O)/C(=N\O)c2cc(Br)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.56
CA2 P00918 5/20 0.56
CA4 P22748 1/20 0.51
CA7 P43166 1/20 0.51
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
PIM1 P11309 1/20 0.45
CUL4A Q13619 1/20 0.42
PLK4 O00444 1/20 0.42
CES1 P23141 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
TTR P02766 1/20 0.40

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
SCHEMBL6324797 1.00 CA1 (0.56) CA1CA2CA4CA7CA12
SCHEMBL25707368 0.80 CA1 (0.50) CA1CA2CA4CA7CA12
SCHEMBL25706960 0.80 CA1 (0.50) CA1CA2CA4CA7CA12
SCHEMBL29174790 0.78 CA1 (0.51) CA1CA2CA4CA7CA12
SCHEMBL18699211 0.78 PIM1 (0.61) CA1CA2CA4CA7CA9
SCHEMBL30704873 0.78 CASP3 (0.62) CA1CA2CA4CA7PIM1
SCHEMBL3005504 0.78 CASP3 (0.62) CA1CA2CA4CA7PIM1
SCHEMBL28957025 0.77 CA1 (0.54) CA1CA2CA4CA7CA12
SCHEMBL13628078 0.77 CUL4A (0.46) CA1CA2CA4CA7CA12
SCHEMBL29698136 0.77 CA1 (0.54) CA1CA2CA4CA7CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969729-B2 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2005-11-29 US claimed
US-20030114513-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S 2003-06-19 US claimed
US-6969729-B2 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2005-11-29 US disclosed
US-20030114513-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S 2003-06-19 US disclosed
EP-0432648-B1 Isatine derivatives, their preparation and use NEUROSEARCH AS (DK) 1995-08-02 EP disclosed
US-5198461-A Isatine derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-03-30 US disclosed
EP-0432648-A2 Isatine derivatives, their preparation and use NEUROSEARCH A/S (DK) 1991-06-19 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 (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-20030114513-A1 Use of isatin derivatives as ion channel activating agents KCNN3, KCNJ2, KCND2 CA1 2537/4885CA2 821/4885CA4 3674/4885

“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.