SCHEMBL9756101

SCHEMBL9756101

CCCC#CC(=O)N(NC(=O)c1ccc(Cl)cc1)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ABCB1 P08183 2/20 0.43
CYP3A4 P08684 1/20 0.42

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
SCHEMBL9755960 0.93 HPGD (0.45) HPGDSMN1; SMN2ABCB1
SCHEMBL9755990 0.92 HPGD (0.44) HPGDSMN1; SMN2ABCB1
SCHEMBL9756441 0.91 HPGD (0.43) HPGDSMN1; SMN2ABCB1
SCHEMBL9756435 0.90 HPGD (0.49) HPGDSMN1; SMN2ABCB1CYP3A4
SCHEMBL9756015 0.87 POLB (0.57) HPGDSMN1; SMN2CYP3A4
SCHEMBL9756215 0.84 HPGD (0.46) HPGDSMN1; SMN2ABCB1CYP3A4
SCHEMBL9756067 0.82 HPGD (0.44) HPGDSMN1; SMN2ABCB1
SCHEMBL9755974 0.82 POLB (0.46) HPGDSMN1; SMN2
SCHEMBL9756099 0.80 SMN1; SMN2 (0.47) HPGDSMN1; SMN2ABCB1CYP3A4
SCHEMBL9755981 0.80 POLB (0.55) CYP3A4

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 3 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-0232075-B1 INSECTICIDAL N'-SUBSTITUTED-N-ALKYLCARBONYL-N'-ACYL HYDRAZINES ROHM AND HAAS COMPANY (US) 1991-03-13 EP disclosed
EP-0234944-A1 Insecticidal N'-substituted-N-acyl-N'-alkylcarbonylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-02 EP disclosed