SCHEMBL7809075

SCHEMBL7809075

CCc1n[nH]c(O)c1C(=O)c1ccc(S(C)(=O)=O)c(OCCC2CCO2)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 2/20 0.34

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
SCHEMBL8508143 0.84 POLB (0.30)
SCHEMBL7814573 0.81 RORC (0.32)
SCHEMBL7811703 0.80
SCHEMBL7807414 0.80 PTGS2 (0.32)
SCHEMBL27274639 0.79 MCL1 (0.36)
SCHEMBL8168637 0.78 GNRHR (0.35) GNRHR
SCHEMBL7802356 0.78 CYP1A2 (0.34)
SCHEMBL8506110 0.76 AKT1 (0.34)
SCHEMBL8508216 0.75
SCHEMBL4969997 0.74 POLB (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077972-A1 1-ALKYL-4-[(3-OXETANYL-)BENZOYL]-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 2001-02-28 EP disclosed
WO-2000017194-A1 1-ALKYL-4-[(3-OXETANYL-)BENZOYL]-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2000-03-30 WO disclosed