SCHEMBL9756050

SCHEMBL9756050

COc1ccccc1C(=O)NN(C(=O)CCCCc1ccccc1)C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
TP53 P04637 1/20 0.49
GLA P06280 1/20 0.49
ALOX5 P09917 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
CTSD P07339 1/20 0.45
NPC1 O15118 1/20 0.44
ABCB1 P08183 1/20 0.44
LMNA P02545 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
SCHEMBL9756165 0.97 HPGD (0.50) HPGDTP53GLAALOX5L3MBTL1
SCHEMBL9755900 0.92 TP53 (0.52) HPGDTP53GLAL3MBTL1CTSD
SCHEMBL9755957 0.92 LMNA (0.46) CTSDABCB1LMNA
SCHEMBL9756329 0.87 CTSD (0.48) TP53CTSDNPC1ABCB1
SCHEMBL9756028 0.86 CTSD (0.47) CTSDABCB1
SCHEMBL9755948 0.86 CTSD (0.47) CTSDABCB1
SCHEMBL9756127 0.86 CTSD (0.47) CTSDABCB1
SCHEMBL9756089 0.86 CTSD (0.47) CTSDABCB1
SCHEMBL9756193 0.86 CTSD (0.47) CTSDABCB1
SCHEMBL9756462 0.86 CTSD (0.49) HPGDTP53CTSDNPC1ABCB1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208790-A1 PROCESS FOR PRODUCING MALEIMIDE COPOLYMER, AND THERMOPLASTIC RESIN PREPARED BY USING SAID COPOLYMER MITSUBISHI RAYON CO., LTD. (JP) 1987-01-21 EP claimed
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
EP-0208790-A1 PROCESS FOR PRODUCING MALEIMIDE COPOLYMER, AND THERMOPLASTIC RESIN PREPARED BY USING SAID COPOLYMER MITSUBISHI RAYON CO., LTD. (JP) 1987-01-21 EP disclosed