SCHEMBL8387698

SCHEMBL8387698

CCOP(=O)(CCC(c1ncn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1)S(C)(=O)=O)OCC

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 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
SCHEMBL8387700 0.89
SCHEMBL9543140 0.85 S1PR2 (0.32)
SCHEMBL8386782 0.84 ALDH1A1 (0.33) ALDH1A1
SCHEMBL8387894 0.84 KCNH2 (0.32) ALDH1A1
SCHEMBL8387674 0.84 POLB (0.35) ALDH1A1
SCHEMBL8389477 0.84 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8386185 0.84 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8386835 0.84 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8386712 0.83 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8386172 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922644-A POSTEMERGENCE HERBICIDES EFFECTIVE AGAINST A BROAD RANGE OF WEED SPECIES; MAY BE USED AS SELECTIVE HERBICIDES IN SOYA, SUGAR BEET, AND OIL-SEED RAPE CROPS ZENECA LIMITED (GB) 1999-07-13 US disclosed
EP-0625873-B1 PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES ZENECA LTD (GB) 1997-11-05 EP disclosed
US-5393732-A Triazole phosphoric acid derivatives and their use as herbicides ZENECA LIMITED (GB) 1995-02-28 US disclosed
EP-0625873-A1 PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES ZENECA LIMITED (GB) 1994-11-30 EP disclosed