SCHEMBL9755903

SCHEMBL9755903

CC(C)(C)N(NC(=O)CCc1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
RECQL P46063 1/20 0.50
HPGD P15428 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HTT P42858 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HDAC1 Q13547 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
SCHEMBL9756166 0.92 SMN1; SMN2 (0.59) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756118 0.91 SMN1; SMN2 (0.52) POLBSMN1; SMN2CYP3A4CYP2C9HPGD
SCHEMBL9756018 0.91 SMN1; SMN2 (0.57) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755986 0.89 ABCB1 (0.57) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755855 0.88 CYP3A4 (0.54) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL8173059 0.85 POLB (0.65) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756280 0.85 POLB (0.65) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9756124 0.83 SMN1; SMN2 (0.50) POLBSMN1; SMN2HPGDHDAC2HDAC8
SCHEMBL8170061 0.83 POLB (0.61) POLBSMN1; SMN2CYP3A4CYP2C9RECQL
SCHEMBL9755939 0.82 HDAC3 (0.51) POLBSMN1; SMN2CYP3A4CYP2C9HPGD

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