SCHEMBL8936196

SCHEMBL8936196

O=C(O)c1cc(CP(=O)(O)O)c2ccc(Cl)cc2n1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IGFBP5 P24593 3/20 0.43
IGFBP3 P17936 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
DHODH Q02127 1/20 0.39
KMO O15229 1/20 0.39

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
Hydrochloric Acid SCHEMBL9602865 0.81 ALOX15 (0.50) IGFBP5IGFBP3
SCHEMBL8936126 0.80 IGFBP5 (0.44) IGFBP5IGFBP3POLBKMT2ADHODH
7-Chlorokynurenic Acid SCHEMBL29386783 0.76 IGFBP3 (0.47) IGFBP5IGFBP3POLBKMT2ADHODH
7-Chlorokynurenic Acid SCHEMBL31238955 0.76 IGFBP3 (0.47) IGFBP5IGFBP3POLBKMT2ADHODH
SCHEMBL15129999 0.76 ALDH1A1 (0.51) IGFBP3POLBKMT2ADHODHKMO
7-Chlorokynurenic Acid SCHEMBL157187 0.76 IGFBP3 (0.47) IGFBP5IGFBP3POLBKMT2ADHODH
SCHEMBL8337206 0.75 DHODH (0.43) IGFBP5IGFBP3POLBKMT2ADHODH
7-Chlorokynurenic Acid SCHEMBL20770380 0.75 IGFBP3 (0.46) IGFBP5IGFBP3POLBKMT2ADHODH
Hydrochloric Acid SCHEMBL5410407 0.74 DHODH (0.42) IGFBP3POLBKMT2ADHODHKMO
SCHEMBL5397913 0.71 KMO (0.46) IGFBP5POLBKMT2ADHODHKMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5510338-A ADMINISTERING TO A MAMMAL TO RELIEVE PAIN AND TO TREAT CONVULSIONS, CEREBRAL ISCHEMIC DAMAGE, AND EMESIS GUILFORD PHARMACEUTICALS INC. (US) 1996-04-23 US disclosed
US-5342946-A Phosphonoalkylquinolin-2-ones as novel antagonists of non-NMDA ionotropic excitatory amino acid receptors GUILFORD PHARMACEUTICALS INC. (US) 1994-08-30 US disclosed