SCHEMBL7573692

SCHEMBL7573692

CSCc1ccc(C(=O)c2cnoc2C2CC2)c(SC)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.34
HPGD P15428 3/20 0.33
ALDH1A1 P00352 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
NAMPT P43490 1/20 0.32
PDE2A O00408 1/20 0.32
S100A4 P26447 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7574021 0.86 DHODH (0.36) DHODHNAMPTPDE2AS100A4
SCHEMBL7573501 0.86 DHODH (0.34) DHODHNAMPTPDE2AS100A4
SCHEMBL7573667 0.86 HTT (0.35) DHODHHPGDALDH1A1SMN1; SMN2NAMPT
SCHEMBL7574673 0.85 NAMPT (0.32) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL7575630 0.84 HPGD (0.35) DHODHHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL8888473 0.83 DHODH (0.36) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL8492364 0.82 HPGD (0.37) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL9116510 0.82 KIT (0.39) DHODHALDH1A1MEN1KMT2A
SCHEMBL7572968 0.81 ALDH1A1 (0.34) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL7575688 0.81 ALDH1A1 (0.34) DHODHHPGDALDH1A1CASP3RAB9A

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
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP claimed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP claimed
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP disclosed
WO-1995022903-A1 NEW PESTICIDAL METHOD RHONE-POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed
US-5374606-A Pre- and postemergence RHONE-POULENC AGRICULTURE LIMITED (GB) 1994-12-20 US disclosed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP disclosed