SCHEMBL9756028

SCHEMBL9756028

CCCCCCC(=O)N(NC(=O)c1ccccc1OC)C(C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.47
ABCB1 P08183 1/20 0.46
HDAC8 Q9BY41 1/20 0.45
HDAC1 Q13547 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 2/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL9756127 1.00 CTSD (0.47) CTSDABCB1HDAC8HDAC1ALDH1A1
SCHEMBL9756193 1.00 CTSD (0.47) CTSDABCB1HDAC8HDAC1ALDH1A1
SCHEMBL9756089 1.00 CTSD (0.47) CTSDABCB1HDAC8HDAC1ALDH1A1
SCHEMBL9755948 1.00 CTSD (0.47) CTSDABCB1HDAC8HDAC1ALDH1A1
SCHEMBL9756329 0.99 CTSD (0.48) CTSDABCB1ALDH1A1MAPK1MAPT
SCHEMBL9756462 0.95 CTSD (0.49) CTSDABCB1ALDH1A1MAPK1MAPT
SCHEMBL9756010 0.90 CTSD (0.51) CTSDABCB1MAPK1MAPTSMN1; SMN2
SCHEMBL9755905 0.87 CTSD (0.43) CTSDABCB1ALDH1A1MAPK1MAPT
SCHEMBL9756349 0.86 CTSD (0.55) CTSDABCB1MAPK1MAPTSMN1; SMN2
SCHEMBL9756050 0.86 HPGD (0.49) CTSDABCB1

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