SCHEMBL7961485

SCHEMBL7961485

CC(=Cc1cc(N2C(=O)C3=C(CCCC3)C2=O)ccc1Cl)C(=O)Cl

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPOX P50336 1/20 0.38
GRM7 Q14831 1/20 0.34
GRM4 Q14833 1/20 0.34
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
BCL2A1 Q16548 1/20 0.33

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
SCHEMBL7961482 1.00 PPOX (0.38) PPOXGRM7GRM4MAPTKMT2A
SCHEMBL24293381 0.89 PPOX (0.40) PPOXMAPTKMT2ABCL2A1
SCHEMBL3676781 0.84 PPOX (0.39) PPOX
SCHEMBL3676777 0.84 PPOX (0.39) PPOX
SCHEMBL24293385 0.83 PPOX (0.38) PPOXMAPTKMT2ABCL2A1
SCHEMBL9775529 0.83 PPOX (0.38) PPOXBCL2A1
SCHEMBL5467830 0.80 MAPT (0.37) PPOXGRM7GRM4MAPTKMT2A
SCHEMBL39177 0.80 MAPT (0.37) PPOXGRM7GRM4MAPTKMT2A
SCHEMBL7162462 0.79 PPOX (0.45) PPOXMAPTKMT2ABCL2A1
SCHEMBL8011326 0.78 PTGDR (0.42) PPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed
EP-0637298-B1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AG (DE) 1999-03-31 EP disclosed
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed
EP-0637298-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF Aktiengesellschaft (DE) 1995-02-08 EP disclosed
WO-1993022280-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AKTIENGESELLSCHAFT (DE) 1993-11-11 WO disclosed