SCHEMBL8437535

SCHEMBL8437535

[CH2]CC(=O)N(CC)CCC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
MLYCD O95822 2/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP8 P22894 1/20 0.30

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
SCHEMBL18407883 0.83 LMNA (0.38) LMNAMLYCDCA12CA1CA9
SCHEMBL5204543 0.79 CA12 (0.44) LMNAMLYCDCA12CA1CA9
SCHEMBL198933 0.78
SCHEMBL18737326 0.77 LMNA (0.34) LMNAMLYCDCA12CA1CA9
SCHEMBL5206297 0.75 CA12 (0.55) LMNACA12CA1CA9MMP1
SCHEMBL13849297 0.75 MMP1 (0.37) LMNAMLYCDCA12CA1CA9
SCHEMBL14200244 0.74 ALDH1A1 (0.34) LMNA
SCHEMBL9004572 0.74 ZDHHC20 (0.39) LMNA
SCHEMBL19289504 0.72
SCHEMBL14200300 0.72 CA12 (0.39) LMNAMLYCDCA12CA1CA9

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-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
WO-1996005179-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-02-22 WO disclosed