SCHEMBL8763702

SCHEMBL8763702

O=C(O)c1noc(C2CC2)c1C(=O)c1ccc(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 3/20 0.41
CYP2C19 P33261 3/20 0.39
HPGD P15428 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 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
SCHEMBL8488143 0.85 MAPT (0.47) SMN1; SMN2ALDH1A1CYP2C19HPGDMAPT
SCHEMBL8761919 0.85 HPD (0.46) ALDH1A1CYP2C19HPGDCYP1A2CYP3A4
SCHEMBL8763711 0.85 KMT2A (0.38) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL8763732 0.80 SMURF2 (0.37) SMN1; SMN2NPC1RAB9A
SCHEMBL8762915 0.80 NR1H4 (0.44)
SCHEMBL8762864 0.80 SMURF2 (0.38) SMN1; SMN2ALDH1A1HPGDNPC1RAB9A
SCHEMBL8489206 0.79 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1CYP2C19HPGDCYP1A2
SCHEMBL8762913 0.79 SMURF2 (0.38) NPC1RAB9A
SCHEMBL8634180 0.76 GPBAR1 (0.38) L3MBTL1POLB
SCHEMBL8762846 0.74 LMNA (0.42) ALDH1A1CYP2C19MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1040940-C Composition containing 4-benzoyl isoxazole derivative and application thereof RHONE POULENE AGRICULTURE LTD (GB) 1998-12-02 CN claimed
EP-0487357-B1 4 Benzoyl isoxazole derivatives RHONE POULENC AGRICULTURE (GB) 1997-07-02 EP claimed
CN-1061596-A 4-Benzoylisoxazole Derivatives RHONE POULENC AGRICULTURE (GB) 1992-06-03 CN claimed
CN-1093537-C Process for preparing composition contg. 4 -benzoyl-iso-oxazole derivs. PHONE POULENC AGRICULTURE LTD (GB) 2002-10-30 CN disclosed
CN-1040940-C Composition containing 4-benzoyl isoxazole derivative and application thereof RHONE POULENE AGRICULTURE LTD (GB) 1998-12-02 CN disclosed
CN-1183411-A Process for preparing composition contg. 4 -benzoyl-iso-oxazole derivs. RHONE POULENC AGRICULTURE (GB) 1998-06-03 CN disclosed
CN-1061596-A 4-Benzoylisoxazole Derivatives RHONE POULENC AGRICULTURE (GB) 1992-06-03 CN disclosed