SCHEMBL9756036

SCHEMBL9756036

CC(C)(C)N(NC(=O)C1CC1)C(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.69
CYP3A4 P08684 2/20 0.60
CYP2C9 P11712 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.53
RECQL P46063 1/20 0.52
HTT P42858 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
MAPT P10636 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL9755963 0.94 POLB (0.61) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756160 0.94 POLB (0.61) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL8173463 0.93 POLB (0.60) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756366 0.93 POLB (0.60) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9755967 0.93 POLB (0.60) POLBCYP3A4CYP2C9SMN1; SMN2RECQL
SCHEMBL9756082 0.85 POLB (0.50) POLBCYP3A4CYP2C9SMN1; SMN2HTT
SCHEMBL9755976 0.85 ABCB1 (0.66) POLBCYP3A4CYP2C9
SCHEMBL9756147 0.84 CYP3A4 (0.56) POLBCYP3A4CYP2C9RECQL
Rh-5849 SCHEMBL1538531 0.82 POLB (1.00) POLBCYP3A4CYP2C9SMN1; SMN2
SCHEMBL9756105 0.80 KMT2A (0.51) POLBCYP3A4CYP2C9SMN1; SMN2HTT

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