SCHEMBL8306874

SCHEMBL8306874

CCn1ncc(C(=O)c2cc(C)c3c(c2C)C(OC)CCS3(=O)=O)c1OS(=O)(=O)c1cc(Cl)ccc1Cl

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.31
HTT P42858 2/20 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
SCHEMBL8307889 0.91 GAA (0.31) GAA
SCHEMBL8303291 0.86 ALDH1A1 (0.31) GAASMN1; SMN2HTT
SCHEMBL8308183 0.86 NPC1 (0.31) SMN1; SMN2
SCHEMBL8011989 0.86
SCHEMBL8307709 0.83
SCHEMBL8941176 0.83 NPC1 (0.30) SMN1; SMN2
SCHEMBL8303756 0.82
SCHEMBL8941061 0.81
SCHEMBL8940912 0.79 ALDH1A1 (0.30) GAASMN1; SMN2HTT
SCHEMBL8308195 0.79 ALDH1A1 (0.30)

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-0768033-B1 HERBICIDAL COMPOSITION IDEMITSU KOSAN CO (JP) 1999-12-08 EP disclosed
EP-0629623-B1 PYRAZOLE DERIVATIVE IDEMITSU KOSAN CO (JP) 1999-05-19 EP disclosed
US-5723408-A NONPHYTOTOXIC SYNERGISTIC MIXTURES IDEMITSU KOSAN CO., LTD. (JP) 1998-03-03 US disclosed
EP-0768033-A1 HERBICIDAL COMPOSITION IDEMITSU KOSAN COMPANY LIMITED (JP) 1997-04-16 EP disclosed
US-5587484-A HALOGENATION; OXIDATION; SULFONATION; HERBICIDES IDEMITSU KOSAN CO., LTD. (JP) 1996-12-24 US disclosed
US-5468722-A Herbicides for corn, wheat, barley IDEMITSU KOSAN CO., LTD. (JP) 1995-11-21 US disclosed