SCHEMBL22790729

SCHEMBL22790729

C=C(CC)NC(C)(C)CCC(C)C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 1/20 0.32
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
SCHEMBL18499701 0.82 MEN1 (0.31) MEN1CYP3A4ALOX15KMT2A
SCHEMBL21541167 0.80
SCHEMBL25491858 0.78 ALDH1A1 (0.48) ALDH1A1
SCHEMBL13126744 0.78 ALDH1A1 (0.46) MEN1KMT2AALDH1A1
SCHEMBL19881271 0.78 MEN1 (0.38) MEN1CYP3A4ALOX15KMT2AALDH1A1
SCHEMBL19881206 0.75 TGFBR1 (0.34) ALDH1A1
SCHEMBL13126745 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL13126747 0.71 ALDH1A1 (0.34) ALDH1A1
SCHEMBL13126740 0.71 ALDH1A1 (0.34) ALDH1A1
SCHEMBL13126746 0.71 ALDH1A1 (0.56) MEN1KMT2AALDH1A1

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-2020252398-A1 PROTEOLYSIS-TARGETING PROTACS INDUCING DEGRADATION OF C-MIC PROTEIN NORTHWESTERN UNIVERSITY (US) 2020-12-17 WO disclosed