SCHEMBL6609340

SCHEMBL6609340

CN1CCc2c(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cc3c(c2C1)NC(=O)C3=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.47
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
CASP9 P55211 1/20 0.46
PKM P14618 1/20 0.44
KMT2A Q03164 3/20 0.42
USP2 O75604 1/20 0.42
BRD4 O60885 1/20 0.42
LMNA P02545 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HTR6 P50406 1/20 0.41
MEN1 O00255 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL8134400 0.91 POLB (0.43) KMT2AUSP2BRD4MEN1SMN1; SMN2
SCHEMBL14287061 0.90 KDM4E (0.44) CASP3CASP1CASP7CASP9PKM
SCHEMBL5099382 0.90 KDM4E (0.44) CASP3CASP1CASP7CASP9PKM
SCHEMBL5099379 0.90 KDM4E (0.44) CASP3CASP1CASP7CASP9PKM
SCHEMBL8140122 0.88 HTR6 (0.39) CASP3CASP1CASP7CASP9HTR6
SCHEMBL8137252 0.87 POLB (0.43) KMT2AUSP2BRD4MEN1SMN1; SMN2
SCHEMBL8133530 0.86 PTGS2 (0.40) BRD4HTR6
SCHEMBL8134085 0.86 LSS (0.46) KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL4370479 0.85 HTR6 (0.47) KMT2ALMNAHTR6MEN1SMN1; SMN2
SCHEMBL8134987 0.82 SMN1; SMN2 (0.42) KMT2AUSP2BRD4LMNAHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869958-B1 NOVEL INDOLE-2,3-DIONE-3-OXIME DERIVATIVES NEUROSEARCH AS (DK) 2004-12-29 EP disclosed
EP-1066037-B1 USE OF INDOLE-2,3-DIONE-3-OXIME DERIVATIVES AS AMPA ANTAGONISTS NEUROSEARCH AS (DK) 2004-12-29 EP disclosed
US-6693111-B1 1H-PYRROLO(3,2-H)ISOQUINOLINE DERIVATIVES; EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS NEUROSEARCH A/S (DK) 2004-02-17 US disclosed
US-RE38200-E1 Capable of antagonizing effect of excitatory amino acids, such as glutamate NEUROSEARCH A/S (DK) 2003-07-22 US disclosed
US-6239128-B1 COMBATING DISEASES AND DISORDERS ASSOCIATED WITH OR MEDIATED BY THE RELEASE OF EXCITATORY AMINO ACIDS, ASSOCIATED WITH REDUCED BLOOD FLOW TO THE BRAIN AND OTHER CNS TISSUE, NEUROSEARCH A/S (DK) 2001-05-29 US disclosed
US-6124285-A Indole-2,3-dione-3-oxime derivatives NEUROSEARCH A/S (DK) 2000-09-26 US disclosed
EP-0781285-B1 FUSED INDOLE AND QUINOXALINE DERIVATIVES, THEIR PREPARATION AND USE AS GLUTAMATE ANTAGONISTS NEUROSEARCH AS (DK) 2000-01-12 EP disclosed
EP-0869958-A1 NOVEL INDOLE-2,3-DIONE-3-OXIME DERIVATIVES NEUROSEARCH A/S (DK) 1998-10-14 EP disclosed
US-5801174-A CEREBROVASCULAR DISORDERS NEUROSEARCH A/S (DK) 1998-09-01 US disclosed
WO-1998014447-A1 NOVEL INDOLE-2,3-DIONE-3-OXIME DERIVATIVES NEUROSEARCH A/S (DK) 1998-04-09 WO disclosed
WO-1996008495-A1 FUSED INDOLE AND QUINOXALINE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 1996-03-21 WO disclosed