SCHEMBL8437331

SCHEMBL8437331

[CH2]CC(=O)NCC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.35
BCHE P06276 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
SCHEMBL8438042 0.79 SMN1; SMN2 (0.34)
SCHEMBL14932882 0.77 CACNA1H (0.36) CACNA1HBCHE
SCHEMBL12028700 0.77 HPGD (0.46) CACNA1HBCHE
SCHEMBL8964 0.77 MEN1 (0.50) CACNA1HBCHE
SCHEMBL3372700 0.75 LMNA (0.38)
SCHEMBL19634469 0.75 CACNA1H (0.35) CACNA1HBCHE
SCHEMBL4866354 0.75 ALDH1A1 (0.48) CACNA1HBCHE
SCHEMBL14902252 0.75 CACNA1H (0.35) CACNA1HBCHE
SCHEMBL993141 0.75 CACNA1H (0.35) CACNA1HBCHE
SCHEMBL7551551 0.74 FAAH (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0777658-B1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AG (DE) 1999-12-15 EP disclosed
US-5885934-A HERBICIDES OR FOR THE DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed
EP-0777658-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-06-11 EP disclosed
WO-1996005179-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-02-22 WO disclosed