SCHEMBL17430659

SCHEMBL17430659

CCc1cccc(CC(=O)[SiH3])c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ MAPK1 P28482 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL1515871 0.82 AKR1B1 (0.58) BCL2LMNAHTTMAPK1TSHR
SCHEMBL13905068 0.82 BCL2 (0.47) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL7770956 0.80 LMNA (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL9035844 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL7770954 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL6650513 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL12164760 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL8255903 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
Acetic Acid SCHEMBL27734248 0.79 BCL2 (0.56) BCL2SMN1; SMN2MAPK1L3MBTL1TSHR
SCHEMBL17430387 0.79 ALDH1A1 (0.52) SMN1; SMN2KMT2ALMNATDP1HPGD

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-2016005474-A1 SITE SELECTIVE CONJUGATION OF AN OLIGONUCLEOTIDE CONJUGATE OR A SMALL MOLECULE TO A METAL BINDING PROTEIN AFFYCON APS (DK) 2016-01-14 — — WO disclosed
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