SCHEMBL9756264

SCHEMBL9756264

CC(C)(C)N(NC(=O)CCCCc1ccccc1)C(=O)c1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.46
RECQL P46063 1/20 0.46
POLB P06746 2/20 0.45
LPAR1 Q92633 1/20 0.44
ALOX5 P09917 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
GPR52 Q9Y2T5 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
SCHEMBL9755992 0.97 CYP3A4 (0.52) CYP3A4CYP2C9SMN1; SMN2RECQLPOLB
SCHEMBL9755855 0.92 CYP3A4 (0.54) CYP3A4CYP2C9SMN1; SMN2RECQLPOLB
SCHEMBL9756330 0.91 HDAC3 (0.45) CYP3A4CYP2C9HDAC1HDAC2
SCHEMBL9756018 0.89 SMN1; SMN2 (0.57) CYP3A4CYP2C9SMN1; SMN2RECQLPOLB
SCHEMBL9756228 0.88 ABCB1 (0.54) CYP3A4CYP2C9SMN1; SMN2POLBLPAR1
SCHEMBL9756046 0.86 CYP3A4 (0.49) CYP3A4CYP2C9RECQLPOLB
SCHEMBL9756039 0.85 CYP3A4 (0.48) CYP3A4CYP2C9RECQLPOLB
SCHEMBL9756516 0.85 CYP3A4 (0.48) CYP3A4CYP2C9RECQLPOLB
SCHEMBL9756252 0.85 CYP3A4 (0.48) CYP3A4CYP2C9RECQLPOLB
SCHEMBL9756002 0.85 CYP3A4 (0.48) CYP3A4CYP2C9RECQLPOLB

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