SCHEMBL9756061

SCHEMBL9756061

C=C(C)C(=O)NN(C(=O)c1ccc(CC)cc1)C(C)(C)C

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.70
HPGD P15428 1/20 0.70
ABCB1 P08183 2/20 0.57
CYP3A4 P08684 1/20 0.57
POLB P06746 1/20 0.46

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
SCHEMBL9509705 0.82 POLB (0.67) SMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL8423072 0.82 HPGD (1.00) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL10771427 0.78 HPGD (0.70) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL9714554 0.78 HPGD (0.89) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL8773650 0.78 HPGD (0.89) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL10719977 0.78 HPGD (0.89) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL9714453 0.77 HPGD (0.86) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL9714459 0.77 HPGD (0.86) SMN1; SMN2HPGDABCB1CYP3A4POLB
Hydrochloric Acid SCHEMBL8174716 0.76 HPGD (0.84) SMN1; SMN2HPGDABCB1CYP3A4POLB
SCHEMBL1045829 0.76 ABCB1 (0.90) SMN1; SMN2HPGDABCB1CYP3A4

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-0347216-A2 Insecticidal N'-substituted-N-alkylcarbonyl-N'-acylhydrazines and N'-substituted -N-acyl-N'-alkylcarbonyl hydrazines ROHM AND HAAS COMPANY (US) 1989-12-20 EP claimed
EP-0234944-B1 INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-04-10 EP disclosed