SCHEMBL8435733

SCHEMBL8435733

C[CH]C(=O)NC(C)(C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.47
POLB P06746 1/20 0.31
TSHR P16473 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
SCHEMBL174734 0.79 TSHR (0.48) PIK3CDPOLBTSHR
SCHEMBL8183701 0.74
SCHEMBL6729525 0.72 PIK3CD (0.52) PIK3CDPOLB
SCHEMBL8435450 0.72 PIK3CD (0.52) PIK3CDPOLB
SCHEMBL6729529 0.72 PIK3CD (0.52) PIK3CDPOLBTSHR
SCHEMBL25443684 0.70 PIK3CD (0.50) PIK3CDPOLBTSHR
SCHEMBL8435445 0.70 PIK3CD (0.50) PIK3CDPOLB
SCHEMBL2690051 0.70 PIK3CD (0.50) PIK3CDPOLBTSHR
SCHEMBL24567743 0.70 PIK3CD (0.56) PIK3CDPOLB
SCHEMBL13218356 0.68 PIK3CD (0.48) PIK3CDPOLB

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