SCHEMBL9756362

SCHEMBL9756362

CC(C)(C)N(NC(=O)C1=CCCCCC1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 1/20 0.46
CYP3A4 P08684 3/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ABCB1 P08183 2/20 0.40

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
SCHEMBL9756357 1.00 HPGD (0.48) HPGDSMN1; SMN2POLBCYP3A4CYP2C9
SCHEMBL9756363 1.00 HPGD (0.48) HPGDSMN1; SMN2POLBCYP3A4CYP2C9
SCHEMBL9756175 0.99 HPGD (0.49) HPGDSMN1; SMN2POLBCYP3A4CYP2C9
SCHEMBL9756364 0.91 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756394 0.91 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756359 0.91 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756181 0.89 HPGD (0.49) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9755887 0.89 POLB (0.51) HPGDSMN1; SMN2POLBCYP3A4CYP2C9
SCHEMBL9756452 0.88 POLB (0.62) HPGDSMN1; SMN2POLBCYP3A4CYP2C9
SCHEMBL9756449 0.88 POLB (0.62) HPGDSMN1; SMN2POLBCYP3A4CYP2C9

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