SCHEMBL8936170

SCHEMBL8936170

C=C(c1ccnc2cc(Cl)ccc12)P(=O)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDE P14735 1/20 0.44
NR4A2 P43354 1/20 0.43
SOS2 Q07890 1/20 0.43
KMT2A Q03164 4/20 0.43
POLB P06746 2/20 0.43
PRNP P04156 2/20 0.43
RXFP1 Q9HBX9 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
THRB P10828 1/20 0.42
KDM4E B2RXH2 4/20 0.41
MAPT P10636 3/20 0.40
HSD17B10 Q99714 2/20 0.40
NSD1 Q96L73 1/20 0.40
CYP1A2 P05177 1/20 0.40
ALDH1A1 P00352 3/20 0.40
NSD2 O96028 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL8936216 0.72 POLB (0.44) IDENR4A2SOS2KMT2APOLB
SCHEMBL13210167 0.71 LMNA (0.54) IDENR4A2SOS2KMT2APOLB
SCHEMBL8936166 0.71 POLB (0.42) IDENR4A2SOS2KMT2APOLB
SCHEMBL9228994 0.70 NR4A2 (0.54) NR4A2SOS2KMT2APOLBPRNP
SCHEMBL5762904 0.70 CYP1A2 (0.58) NR4A2SOS2KMT2APOLBPRNP
SCHEMBL8367161 0.69 NR4A2 (0.58) NR4A2SOS2KMT2APOLBPRNP
Hydrochloric Acid SCHEMBL9229003 0.68 CYP1A2 (0.56) NR4A2SOS2KMT2APOLBPRNP
SCHEMBL10377143 0.68 POLB (0.63) IDENR4A2SOS2KMT2APOLB
SCHEMBL9228099 0.66 MAPT (0.52) NR4A2SOS2KMT2APOLBPRNP
SCHEMBL8071610 0.65 NR4A2 (0.40) IDENR4A2SOS2KMT2APOLB

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