SCHEMBL28245985

SCHEMBL28245985

CC(C)(C(=O)O)C(c1ccccc1)[Si](C)(C)C.[Zn]

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ LMNA P02545 3/20 0.37
▸ CES2 O00748 2/20 0.37
▸ CES1 P23141 2/20 0.37
▸ OPRK1 P41145 2/20 0.37
▸ AOC3 Q16853 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL60356 0.74 AOC3 (0.57) KMT2AL3MBTL1TDP1CYP2D6ATM
SCHEMBL11663964 0.74 L3MBTL1 (0.45) KMT2AL3MBTL1TDP1CYP2D6ATM
SCHEMBL9683893 0.74 AOC3 (0.57) KMT2AL3MBTL1TDP1CYP2D6ATM
SCHEMBL2896278 0.74 NR3C1 (0.47) KMT2AL3MBTL1TDP1CYP2D6ATM
SCHEMBL10198841 0.73 SLC6A2 (0.48) KMT2ALMNAMAPK1NR3C1
SCHEMBL7836925 0.72 AOC3 (0.46) L3MBTL1TDP1CYP2D6SRCLMNA
SCHEMBL173884 0.72 L3MBTL1 (0.43) KMT2AL3MBTL1TDP1CYP2D6ATM
SCHEMBL11076796 0.71 L3MBTL1 (0.39) KMT2AL3MBTL1TDP1CYP2D6ATM
SCHEMBL10839951 0.71 L3MBTL1 (0.49) KMT2AL3MBTL1TDP1CYP2D6ATM
Hydrochloric Acid SCHEMBL7826397 0.71 ALDH1A1 (0.45) L3MBTL1TDP1CYP2D6SRCLMNA

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
CN-108586500-A Zinc co-ordination complex and the method for preparing organic zinc reagent 慕尼黑路德维希马克西米利安斯大学 2018-09-28 — — CN disclosed
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