SCHEMBL9429384

SCHEMBL9429384

CON1C(C)(C)CC(CCCCNc2nc(NCCO)nc(NCCCCCCNc3nc(NCCO)nc(NCCCCC4CC(C)(C)N(OC)C(C)(C)C4)n3)n2)CC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
GBA1 P04062 7/20 0.35
SLC29A1 Q99808 4/20 0.35
KCNH3 Q9ULD8 2/20 0.33
EHMT2 Q96KQ7 1/20 0.33
EHMT1 Q9H9B1 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL9427851 0.99 KMT2A (0.40) KMT2AGBA1SLC29A1KCNH3EHMT2
SCHEMBL9428044 0.88 KMT2A (0.34) KMT2A
SCHEMBL9428396 0.88 KMT2A (0.42) KMT2A
SCHEMBL9428715 0.87 SLC29A1 (0.38) KMT2ASLC29A1
SCHEMBL7458930 0.86 KMT2A (0.40) KMT2A
SCHEMBL9422664 0.86 HTR7 (0.37) GAA
SCHEMBL9429306 0.86 HTR2C (0.33) KMT2AEHMT1MAPK1SMN1; SMN2
SCHEMBL9429015 0.85 KMT2A (0.49) KMT2AGBA1SLC29A1KCNH3EHMT2
SCHEMBL9428703 0.85 KMT2A (0.49) KMT2AGBA1SLC29A1KCNH3EHMT2
SCHEMBL9428382 0.85 KMT2A (0.49) KMT2AGBA1SLC29A1KCNH3EHMT2

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-5300544-A Non-migrating 1-hydrocarbyloxy-2,2,6,6-tetramethylpiperdine 1,3,5-triazine derivatives as polymer stabilizers CIBA-GEIGY CORPORATION (US) 1994-04-05 US disclosed