SCHEMBL9639155

SCHEMBL9639155

CCCCCCCCCCCCCOC(=O)CC(Sc1nc(S)ns1)C(=O)OCCCCCCCCCCCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
FAAH O00519 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RAD52 P43351 1/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX1 P07099 1/20 0.34
HTR2C P28335 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33

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
SCHEMBL9875737 0.81 NAAA (0.44) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL9639106 0.81 NAAA (0.39) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL9639601 0.81 NAAA (0.39) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL9875718 0.75 RAB9A (0.41) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL9639099 0.74 ALDH1A1 (0.51) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL10809555 0.69 NAAA (0.51) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL10809940 0.69 NAAA (0.51) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL12611017 0.69 NAAA (0.51) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL1108064 0.67 NAAA (0.49) NAAAFAAHNPSR1MAPTMAPK1
SCHEMBL13714394 0.67 NAAA (0.49) NAAAFAAHNPSR1MAPTMAPK1

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
US-5102568-A Antioxidants, corrosion resistance and wear resistance ATOCHEM NORTH AMERICA, INC. (US) 1992-04-07 US disclosed
EP-0218816-B1 THIADIAZOLE COMPOUNDS AND LUBRICANT ADDITIVES THEREOF PENNWALT CORPORATION (US) 1990-09-26 EP disclosed
EP-0242395-A1 THIADIAZOLE COMPOUNDS AND LUBRICANT ADDITIVES THEREOF PENNWALT CORPORATION (US) 1987-10-28 EP disclosed
WO-1987002358-A1 THIADIAZOLE COMPOUNDS AND LUBRICANT ADDITIVES THEREOF PENNWALT CORPORATION (US) 1987-04-23 WO disclosed
EP-0218816-A1 Thiadiazole compounds and lubricant additives thereof PENNWALT CORPORATION (US) 1987-04-22 EP disclosed