SCHEMBL9756293

SCHEMBL9756293

CCC#CCCC(=O)NN(C(=O)c1ccccc1OC)C(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.42
CTSD P07339 1/20 0.39
LMNA P02545 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL9755962 0.89 ABCB1 (0.43) ABCB1CTSDLMNAHDAC1
SCHEMBL9755901 0.87 HDAC8 (0.42) ABCB1HDAC8HDAC1
SCHEMBL9756008 0.86 MAPT (0.46) ABCB1CTSD
SCHEMBL9756229 0.84 ABCB1 (0.42) ABCB1CTSDLMNAHDAC1
SCHEMBL9755896 0.84 ALDH1A1 (0.48) HDAC8HDAC1
SCHEMBL9756344 0.83 ABCB1 (0.51) ABCB1
SCHEMBL9756218 0.83 ABCB1 (0.44) ABCB1CTSDLMNA
SCHEMBL9755928 0.83 ABCB1 (0.47) ABCB1CTSDLMNA
SCHEMBL9756326 0.83 HDAC8 (0.49) HDAC8HDAC1
SCHEMBL9756295 0.82 CTSD (0.45) ABCB1CTSDLMNA

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