SCHEMBL9756095

SCHEMBL9756095

Cc1cccc(C(=O)NN(C(=O)C(C)(C)C)C(C)(C)C)c1C

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 3/20 0.51
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL10718620 0.87 ABCB1 (0.59) ABCB1
SCHEMBL9756314 0.83 ABCB1 (0.49) ABCB1
SCHEMBL10770456 0.82 ABCB1 (0.48) ABCB1
SCHEMBL8461192 0.80 ABCB1 (0.81) ABCB1CYP3A4
SCHEMBL32672049 0.80 ABCB1 (0.81) ABCB1CYP3A4
SCHEMBL9755988 0.80 ABCB1 (0.46) ABCB1
SCHEMBL10722332 0.80 ABCB1 (0.55) ABCB1
SCHEMBL10719133 0.80 ABCB1 (0.70) ABCB1
SCHEMBL9425891 0.79 ABCB1 (0.57) ABCB1CYP3A4CYP2C9
SCHEMBL10721297 0.79 ABCB1 (0.51) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0234944-B1 INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-04-10 EP disclosed
EP-0234944-A1 Insecticidal N'-substituted-N-acyl-N'-alkylcarbonylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-02 EP disclosed