SCHEMBL8998931

SCHEMBL8998931

COc1cccc(C(=O)NN(C(=O)c2ccc(C)cc2)C(C)(C)C)c1C

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.81
RAB9A P51151 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL8998770 0.92 ABCB1 (0.76) ABCB1RAB9APOLB
SCHEMBL8383736 0.92 ABCB1 (0.79) ABCB1POLB
SCHEMBL8998803 0.91 ABCB1 (0.74) ABCB1
Methoxyfenozide SCHEMBL27595 0.89 ABCB1 (1.00) ABCB1
Methoxyfenozide SCHEMBL27901977 0.88 ABCB1 (0.98) ABCB1
SCHEMBL5053856 0.88 ABCB1 (0.85) ABCB1RAB9A
SCHEMBL8998835 0.87 ABCB1 (0.76) ABCB1
SCHEMBL5064013 0.87 ABCB1 (0.76) ABCB1
SCHEMBL5056990 0.87 ABCB1 (0.76) ABCB1
SCHEMBL5058444 0.86 ABCB1 (0.74) 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-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
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
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