SCHEMBL27465197

SCHEMBL27465197

CCOC(=O)Nc1ccccc1C(=O)OCl

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
ALDH1A1 P00352 8/20 0.57
HPGD P15428 2/20 0.56
KDM4E B2RXH2 8/20 0.56
HSD17B10 Q99714 3/20 0.56
LMNA P02545 3/20 0.55
NPSR1 Q6W5P4 2/20 0.53
TP53 P04637 1/20 0.53
HTT P42858 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
TSHR P16473 4/20 0.52
MAPK10 P53779 1/20 0.52
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL31126834 0.89 KDM4E (0.68) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL2860044 0.89 KDM4E (0.68) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL4474267 0.88 CYP1A2 (0.74) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL11370286 0.85 MEN1 (0.59) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL11421007 0.84 MEN1 (0.62) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL27451251 0.84 KMT2A (0.56) KMT2ASMN1; SMN2CYP1A2CYP2C19ALDH1A1
SCHEMBL19805148 0.83 MEN1 (0.68) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL10489819 0.83 KMT2A (0.63) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL28401182 0.82 ALDH1A1 (0.72) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL10807728 0.81 MEN1 (0.62) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1137271-A 4-benzoylisoxazoles and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1996-12-04 CN disclosed