SCHEMBL19787813

SCHEMBL19787813

CCCC(C)(C)C(=O)N(C)CC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 17/20 0.37
ELANE P08246 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL23613545 0.79 ACLY (0.41) RIPK1TDP1
SCHEMBL5264333 0.77 ALDH1A1 (0.40) RIPK1ELANEMEN1KMT2ATDP1
SCHEMBL8962266 0.77 RIPK1 (0.38) RIPK1MEN1KMT2A
SCHEMBL23469843 0.76 ALDH1A1 (0.38) RIPK1ALDH1A1
SCHEMBL26351138 0.74 DNM1 (0.37) RIPK1ALDH1A1
SCHEMBL23613549 0.72 PPARA (0.32) TDP1
SCHEMBL23613340 0.72 ACACB (0.46) MEN1KMT2A
SCHEMBL17615113 0.71 NPC1 (0.31)
SCHEMBL14010563 0.71
SCHEMBL276239 0.71

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
US-9872918-B2 Hydroxyl-polymer-drug-protein conjugates MERSANA THERAPEUTICS, INC. (US) 2018-01-23 US disclosed