SCHEMBL9756181

SCHEMBL9756181

CC(C)(C)N(NC(=O)c1ccc(Cl)cc1)C(=O)C1=CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.47
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 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
SCHEMBL9756359 0.99 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756394 0.99 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756364 0.99 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756175 0.90 HPGD (0.49) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9755891 0.90 POLB (0.51) HPGDSMN1; SMN2POLB
SCHEMBL9756357 0.89 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756362 0.89 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9756363 0.89 HPGD (0.48) HPGDSMN1; SMN2POLBNPC1ALDH1A1
SCHEMBL9507237 0.88 POLB (0.63) HPGDSMN1; SMN2POLB
SCHEMBL9756450 0.86 POLB (0.62) HPGDSMN1; SMN2POLB

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-0234944-A1 Insecticidal N'-substituted-N-acyl-N'-alkylcarbonylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-02 EP disclosed