SCHEMBL8998725

SCHEMBL8998725

COc1cccc(C(=O)NN(C(=O)c2cc(C)ccc2Cl)C(C)(C)C)c1C

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.70

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
SCHEMBL5058447 0.92 ABCB1 (0.63) ABCB1
SCHEMBL5056990 0.91 ABCB1 (0.76) ABCB1
SCHEMBL9237401 0.89 ABCB1 (0.72) ABCB1
SCHEMBL5058444 0.88 ABCB1 (0.74) ABCB1
SCHEMBL8998795 0.88 ABCB1 (0.59) ABCB1
SCHEMBL9102689 0.86 ABCB1 (0.71) ABCB1
SCHEMBL8998763 0.85 ABCB1 (0.64) ABCB1
SCHEMBL8998880 0.85 ABCB1 (0.73) ABCB1
SCHEMBL8998827 0.85 ABCB1 (0.67) ABCB1
SCHEMBL8998815 0.84 ABCB1 (0.72) ABCB1

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
US-5530028-A CONTROLS INSECTS OF THE ORDER LEPIDOPTERA ROHM AND HAAS COMPANY (US) 1996-06-25 US claimed
EP-0602794-A2 Insecticidal N'-substituted-N, N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1994-06-22 EP claimed
EP-0729934-A2 A process for producing a 3-alkoxy-2-(substituted)benzoic acid or an ester thereof ROHM AND HAAS COMPANY (US) 1996-09-04 EP disclosed
EP-0729953-A2 A process for producing a 2-substituted-3,4-fused heterocyclic benzoic acid ROHM AND HAAS COMPANY (US) 1996-09-04 EP disclosed
US-5530028-A CONTROLS INSECTS OF THE ORDER LEPIDOPTERA ROHM AND HAAS COMPANY (US) 1996-06-25 US disclosed
EP-0602794-A2 Insecticidal N'-substituted-N, N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1994-06-22 EP disclosed