SCHEMBL7575701

SCHEMBL7575701

CS(=O)(=O)Cc1ccccc1C(=O)c1cnoc1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 8/20 0.40
HCRTR1 O43613 2/20 0.40
DHODH Q02127 3/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
PDE2A O00408 1/20 0.33
CNR1 P21554 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
NR1H4 Q96RI1 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7575147 0.89 DHODH (0.34) HCRTR2HCRTR1DHODHTAS1R3TAS1R1
SCHEMBL9116513 0.87 DHODH (0.33) HCRTR2HCRTR1DHODHTAS1R3TAS1R1
SCHEMBL9115234 0.86 PDE2A (0.33) HCRTR2HCRTR1DHODHTAS1R3TAS1R1
SCHEMBL9116676 0.86 CYP2D6 (0.37) DHODHLMNASMN1; SMN2
SCHEMBL8891242 0.86 HCRTR2 (0.35) HCRTR2HCRTR1DHODHTAS1R3TAS1R1
SCHEMBL6054845 0.85 DHODH (0.33) DHODHPDE2APOLB
SCHEMBL7573465 0.85 DHODH (0.33) DHODHPDE2ALMNA
SCHEMBL7573670 0.85 SLC6A9 (0.35) DHODHPDE2ALMNASMN1; SMN2
SCHEMBL8890477 0.84 NR3C1 (0.38) DHODHTAS1R3TAS1R1TAS1R2LMNA
SCHEMBL8747888 0.84 KDM4E (0.37) DHODHTAS1R3TAS1R1TAS1R2PDE2A

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 8 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
EP-0625505-B1 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1998-10-28 EP disclosed
CN-1100261-A Herbicides RHONE POULENC AGRICULTURE (GB) 1995-03-22 CN disclosed
US-5374606-A Pre- and postemergence RHONE-POULENC AGRICULTURE LIMITED (GB) 1994-12-20 US disclosed
EP-0625505-A2 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-11-23 EP disclosed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP disclosed