SCHEMBL7811558

SCHEMBL7811558

CCn1nc(C)c(C(=O)c2ccc(S(C)(=O)=O)c(OC3COC3)c2Cl)c1O

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL7807427 0.88
SCHEMBL8175159 0.84 RAB9A (0.32) KMT2A
SCHEMBL7810791 0.82 RORC (0.33) KMT2A
SCHEMBL7811746 0.80 FPR2 (0.30)
SCHEMBL8176400 0.78 KAT2B (0.30)
SCHEMBL7811703 0.78
SCHEMBL8168140 0.77 SMN1; SMN2 (0.32)
SCHEMBL7807424 0.75 PRKAB2 (0.38)
SCHEMBL1038432 0.73 FPR1 (0.32)
SCHEMBL1962187 0.73 HCRTR1 (0.32) KMT2A

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 3 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
US-6140271-A 1-ETHYL-4-(2-METHYL-3-(3-OXETANYLOXY)-4-METHYLSULFONYLBENZOYL) -5-HYDROXYPYRAZOLE, FOR EXAMPLE AND BENZOIC ACID CHEMICAL INTERMEDIATES; POSTEMERGENCE HERBICIDES DOW AGROSCIENCES LLC (US) 2000-10-31 US 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