SCHEMBL8570856

SCHEMBL8570856

Cc1cc(Cl)c2c(O)c(C(=O)O)c(C(=O)O)nc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.40
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
LMNA P02545 1/20 0.36
GRIK1 P39086 1/20 0.36
GRIA1 P42261 1/20 0.36
GRIA2 P42262 1/20 0.36
GRIA3 P42263 1/20 0.36
GRIA4 P48058 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIK2 Q13002 1/20 0.36
GRIK3 Q13003 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIK4 Q16099 1/20 0.36
GRIK5 Q16478 1/20 0.36

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
SCHEMBL8569839 0.85 AKR1C4 (0.42) DHODHALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL6229826 0.82 GRIN2D (0.39) DHODHALDH1A1SMN1; SMN2MAPK1GRIN2D
SCHEMBL8571310 0.79 DHODH (0.43) DHODHALDH1A1SMN1; SMN2MAPK1KMT2A
SCHEMBL8575358 0.79 DHODH (0.42) DHODHALDH1A1GRIN2DGRIN3BLMNA
SCHEMBL8572170 0.79 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2KMT2AMAPTNPC1
SCHEMBL8574037 0.79 GRIN2D (0.44) DHODHALDH1A1SMN1; SMN2MAPK1GRIN2D
SCHEMBL8574385 0.79 DHODH (0.49) DHODHALDH1A1SMN1; SMN2MAPK1KMT2A
SCHEMBL6233183 0.75 PLA2G2A (0.42) KMT2AMEN1CDK9DYRK1AAKR1C2
SCHEMBL8567850 0.75 TPMT (0.41) DHODHALDH1A1GRIN2DGRIN3BLMNA
SCHEMBL8567912 0.73 DHODH (0.54) DHODHALDH1A1KMT2AMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739133-A N-ACYLATED AND ALKYLATED DERIVATIVES OF PYRIDAZINO(4,5-B)-QUINOLINES; EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS; STROKES; ANTIISCHEMIC AND HYPOGLYCEMIC AGENTS; PSYCHOSIS; NEUROGODEGENERATIVE DISORDERS ZENECA LIMITED (GB) 1998-04-14 US disclosed
US-5733910-A Pyridazinedione compounds useful in the treating neurological disorders IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1998-03-31 US disclosed
US-5604227-A EXCITATORY AMINO ACID ANTAGONIST; MONO, DI OR TRI-ACETYLATION OR ALKYLATION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1997-02-18 US disclosed
US-5599814-A SUBSTITUTED PYRIDAZINO(4,5-B)QUINOLINES AS ANTAGONISTS OF EXCITATORY AMINO ACIDS IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1997-02-04 US disclosed
EP-0516297-B1 Pyridazinediones and their use in the treatment of neurological disorders ZENECA LTD (GB) 1996-10-30 EP disclosed
EP-0516297-A1 Pyridazinediones and their use in the treatment of neurological disorders ZENECA LIMITED (GB) 1992-12-02 EP disclosed