SCHEMBL9756124

SCHEMBL9756124

CC(C)(C)N(NC(=O)CCCc1ccccc1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
POLB P06746 1/20 0.49
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
NFKB1 P19838 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
MCL1 Q07820 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL9756004 0.96 SMN1; SMN2 (0.49) SMN1; SMN2POLBHDAC3HDAC1HDAC2
SCHEMBL9756118 0.93 SMN1; SMN2 (0.52) SMN1; SMN2POLBALDH1A1MAPTHPGD
SCHEMBL9755939 0.92 HDAC3 (0.51) SMN1; SMN2POLBHDAC3HDAC1HDAC2
SCHEMBL9756166 0.91 SMN1; SMN2 (0.59) SMN1; SMN2POLBHDAC3HDAC1HDAC2
SCHEMBL9756112 0.90 HDAC3 (0.55) SMN1; SMN2HDAC3HDAC1HDAC2HDAC8
SCHEMBL9756018 0.88 SMN1; SMN2 (0.57) SMN1; SMN2POLBHDAC1HDAC2
SCHEMBL9755966 0.85 SMN1; SMN2 (0.54) SMN1; SMN2POLBMAPTHPGD
SCHEMBL9756353 0.84 HPGD (0.50) SMN1; SMN2POLBALDH1A1HPGD
SCHEMBL9755903 0.83 POLB (0.61) SMN1; SMN2POLBHDAC1HDAC2HDAC8
SCHEMBL9756425 0.83 ALDH1A1 (0.52) SMN1; SMN2POLBALDH1A1HPGD

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