SCHEMBL6322389

SCHEMBL6322389

CON=C1C(=O)N(C)c2c1cc([N+](=O)[O-])c1c2CCCC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 4/20 0.35
GRIA2 P42262 4/20 0.35
GRIA3 P42263 4/20 0.35
GRIA4 P48058 4/20 0.35
MAPT P10636 5/20 0.33
MAPK1 P28482 2/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.31
LMNA P02545 2/20 0.31
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL6324054 0.80 RAB9A (0.38) MAPTMAPK1GAAPOLBRAB9A
SCHEMBL6324060 0.80 RAB9A (0.38) MAPTMAPK1GAAPOLBRAB9A
SCHEMBL6319581 0.78 CASP1 (0.39) MAPTKMT2AMEN1POLBRAB9A
SCHEMBL6319586 0.78 CASP1 (0.39) MAPTKMT2AMEN1POLBRAB9A
SCHEMBL6317012 0.77 HTT (0.38) MAPTKMT2AMEN1RAB9ALMNA
SCHEMBL6317014 0.77 HTT (0.38) MAPTKMT2AMEN1RAB9ALMNA
SCHEMBL6318570 0.69 CASP1 (0.36) KMT2AMEN1POLBALDH1A1HTT
SCHEMBL6318568 0.69 CASP1 (0.36) KMT2AMEN1POLBALDH1A1HTT
SCHEMBL6315053 0.66 CASP1 (0.63) MAPTKMT2AMEN1RAB9ALMNA
SCHEMBL6315054 0.66 CASP1 (0.63) MAPTKMT2AMEN1RAB9ALMNA

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 8 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-20020016354-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2002-02-07 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
US-20020016354-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2002-02-07 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

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-20030114513-A1 Use of isatin derivatives as ion channel activating agents KCNN3, KCNJ2, KCND2 GRIA1 1146/4885GRIA2 958/4885GRIA3 1012/4885
US-20020016354-A1 Use of isatin derivatives as ion channel activating agents KCNN3, KCNJ2, KCND2 GRIA1 1127/4885GRIA2 845/4885GRIA3 974/4885

“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.