SCHEMBL9756013

SCHEMBL9756013

CCCC#CC(=O)NN(C(=O)c1ccccc1)C(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.51
CYP3A4 P08684 2/20 0.50
CYP2C9 P11712 2/20 0.50
RECQL P46063 1/20 0.47
HPGD P15428 1/20 0.46
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL9755978 0.92 POLB (0.55) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755951 0.91 POLB (0.53) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756455 0.90 POLB (0.52) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755877 0.89 POLB (0.60) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756099 0.87 SMN1; SMN2 (0.47) POLBSMN1; SMN2CYP3A4CYP2C9HPGD
SCHEMBL9756102 0.87 ABCB1 (0.56) POLBCYP3A4CYP2C9HPGD
SCHEMBL9756090 0.86 CYP3A4 (0.47) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756318 0.83 POLB (0.56) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755878 0.81 POLB (0.53) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756139 0.81 ABCB1 (0.43) LMNA

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-0232075-A1 Insecticidal N'-substituted-N-alkylcarbonyl-N'-acyl hydrazines ROHM AND HAAS COMPANY (US) 1987-08-12 EP disclosed