SCHEMBL8724629

SCHEMBL8724629

CCSc1c(Cl)ccc(C(=O)c2cnoc2C2CC2)c1SC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.32
PDE2A O00408 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 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
SCHEMBL8752728 0.92 PDE2A (0.32) DHODHPDE2A
SCHEMBL8752743 0.91 DHODH (0.36) DHODHPDE2AALDH1A1HPGDMEN1
SCHEMBL8492504 0.85 DHODH (0.35) DHODHPDE2AALDH1A1HPGDMEN1
SCHEMBL8752744 0.85 DHODH (0.32) DHODHPDE2AMEN1KMT2A
SCHEMBL7574528 0.85 DHODH (0.31) DHODH
SCHEMBL8492889 0.84 PDE2A (0.36) DHODHPDE2AALDH1A1MAPTHPGD
SCHEMBL8492849 0.84 DHODH (0.36) DHODHPDE2AALDH1A1HPGDMEN1
SCHEMBL7583005 0.83 DHODH (0.32) DHODHPDE2AMEN1KMT2A
SCHEMBL7577256 0.83 DHODH (0.32) DHODHPDE2AMEN1KMT2A
SCHEMBL9116657 0.83 DHODH (0.40) DHODHPDE2AALDH1A1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0682659-B1 4-Benzoyl isoxazole derivatives, their preparation and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1997-04-16 EP claimed
EP-0682659-A1 4-BENZOYL ISOXAZOLES AND THEIR USE AS HERBICIDES. RHONE POULENC AGRICULTURE (GB) 1995-11-22 EP claimed
WO-1994018179-A1 4-BENZOYL ISOXAZOLES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD (GB) 1994-08-18 WO claimed
CN-1083688-C New herbicides RHONE POULENC AGRICULTURE (GB) 2002-05-01 CN disclosed
EP-0625508-B1 Sulfur-containing derivatives of 2-cyano-1,3-diones and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1998-08-19 EP disclosed
EP-0682659-B1 4-Benzoyl isoxazole derivatives, their preparation and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1997-04-16 EP disclosed
EP-0682659-A1 4-BENZOYL ISOXAZOLES AND THEIR USE AS HERBICIDES. RHONE POULENC AGRICULTURE (GB) 1995-11-22 EP disclosed
CN-1104030-A New herbicides RHONE POULENC AGRICULTURE (GB) 1995-06-28 CN disclosed
EP-0625508-A2 Sulfur-containing derivatives of 2-cyano-1,3-diones and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-11-23 EP disclosed
WO-1994018179-A1 4-BENZOYL ISOXAZOLES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD (GB) 1994-08-18 WO disclosed