SCHEMBL8993464

SCHEMBL8993464

CC(C)Cc1cccc([C@@H](C=O)O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
PNMT P11086 1/20 0.31
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL7712823 0.79 ACP3 (0.34)
SCHEMBL4542209 0.79 ACP3 (0.34)
SCHEMBL15517838 0.79 HDAC4 (0.35)
SCHEMBL4583472 0.77 ATM (0.36)
SCHEMBL8402080 0.77 ATM (0.36)
SCHEMBL8406168 0.77 ATM (0.36)
SCHEMBL7567572 0.74 GABRA1 (0.33)
SCHEMBL7567576 0.74 GABRA1 (0.33)
SCHEMBL12497813 0.71 SLC6A3 (0.33)
SCHEMBL8993490 0.70 FFAR2 (0.35) TP53TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5504108-A ANTIAGGLOMERANTS, ANTIARTHRITIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1996-04-02 US disclosed
WO-1995023139-A1 OPTICALLY PURE 4-ARYL-2-HYDROXYTETRONIC ACIDS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1995-08-31 WO disclosed