SCHEMBL9755872

SCHEMBL9755872

CCCCCCC(=O)NN(C(=O)c1ccc(Cl)cc1)C(C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL9756121 1.00 ALDH1A1 (0.51) ALDH1A1KDM4EPOLBHPGDSMN1; SMN2
SCHEMBL9755848 1.00 ALDH1A1 (0.51) ALDH1A1KDM4EPOLBHPGDSMN1; SMN2
SCHEMBL9756343 1.00 ALDH1A1 (0.51) ALDH1A1KDM4EPOLBHPGDSMN1; SMN2
SCHEMBL9756145 1.00 ALDH1A1 (0.51) ALDH1A1KDM4EPOLBHPGDSMN1; SMN2
SCHEMBL9756425 0.99 ALDH1A1 (0.52) ALDH1A1KDM4EPOLBHPGDSMN1; SMN2
SCHEMBL9756353 0.95 HPGD (0.50) ALDH1A1KDM4EPOLBHPGDSMN1; SMN2
SCHEMBL9755949 0.89 HPGD (0.52) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9755980 0.87 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9756190 0.87 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9755993 0.87 POLB (0.58) POLBSMN1; SMN2CYP3A4CYP2C9

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 2 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