SCHEMBL7469191

SCHEMBL7469191

CCOc1csc2ccc(C(=O)c3cnoc3C3CC3)c(SC)c12

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 2/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
DHODH Q02127 1/20 0.30
PDE2A O00408 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
SCHEMBL7467864 0.88 HCRTR2 (0.33) HCRTR2S1PR1S1PR3DHODHPDE2A
SCHEMBL8492827 0.79 HPGD (0.39) DHODH
SCHEMBL7464239 0.77 DHODH (0.32) DHODHPDE2A
SCHEMBL7462608 0.77 STAT3 (0.35) DHODHPDE2A
SCHEMBL9113812 0.75 SMN1; SMN2 (0.33) DHODHPDE2A
SCHEMBL7469824 0.74 TSHR (0.42) DHODH
Hydrochloric Acid SCHEMBL7464266 0.73 TSHR (0.41) DHODH
SCHEMBL7464261 0.73 KMT2A (0.34)
SCHEMBL8605928 0.73 DHODH (0.36) DHODHPDE2A
SCHEMBL8752752 0.73 DHODH (0.36) DHODHPDE2A

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
EP-0636622-B1 Isoxazole derivatives and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-23 EP claimed
US-5489570-A PRE- OR POST-EMERGENCE RHONE-POULENC AGRICULTURE LIMITED (GB) 1996-02-06 US claimed
EP-0636622-A1 Isoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1995-02-01 EP claimed
EP-0636622-B1 Isoxazole derivatives and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-23 EP disclosed
EP-1160244-A1 Isoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LIMITED (GB) 2001-12-05 EP disclosed
US-5489570-A PRE- OR POST-EMERGENCE RHONE-POULENC AGRICULTURE LIMITED (GB) 1996-02-06 US disclosed
EP-0636622-A1 Isoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1995-02-01 EP disclosed