SCHEMBL19684408

SCHEMBL19684408

CC(CF)CCCC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.31
RIPK1 Q13546 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
SCHEMBL15489500 0.84 RIPK1 (0.37) RIPK1
SCHEMBL18893576 0.84 RIPK1 (0.37) RIPK1
SCHEMBL19118274 0.79 MEN1 (0.42) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL1517434 0.77 MEN1 (0.36) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL23867079 0.75 LMNA (0.62) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL1436756 0.75 MEN1 (0.39) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL11763336 0.75 ALOX15 (0.41) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL17314985 0.75 ACE2 (0.42) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL1426138 0.75 TSHR (0.46) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL11688603 0.75 MEN1 (0.35) MEN1CYP3A4ALOX15KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017210685-A1 PYRADAZINONE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME An2H Discovery Limited (IE) 2017-12-07 WO disclosed