SCHEMBL9304310

SCHEMBL9304310

CC(C=O)C(OCc1ccccc1)C(C)CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
BTN3A1 O00481 1/20 0.36
BACE1 P56817 1/20 0.35
CYP2C19 P33261 5/20 0.35
CYP3A4 P08684 4/20 0.35
CYP2C9 P11712 3/20 0.35
SLC1A3 P43003 2/20 0.33
SLC1A2 P43004 2/20 0.33
SLC1A1 P43005 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
ELANE P08246 1/20 0.32
CTSB P07858 1/20 0.31
RCE1 Q9Y256 1/20 0.31
ATM Q13315 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
SCHEMBL9304303 1.00 MAPT (0.41) MAPTBTN3A1BACE1CYP2C19CYP3A4
SCHEMBL5820033 0.88 IDO1 (0.35) MAPTBACE1CYP2C19CYP3A4CYP2C9
SCHEMBL1751842 0.88 IDO1 (0.35) MAPTBACE1CYP2C19CYP3A4CYP2C9
SCHEMBL9304192 0.81 BTN3A1 (0.33) MAPTBTN3A1BACE1CYP2C19CYP3A4
SCHEMBL7530664 0.80 CA1 (0.37) MAPTSLC1A1KMT2ATSHRELANE
SCHEMBL9305298 0.78 MAPT (0.38) MAPTBTN3A1BACE1CYP2C19CYP3A4
SCHEMBL9305302 0.78 MAPT (0.38) MAPTBTN3A1BACE1CYP2C19CYP3A4
SCHEMBL1751064 0.77
SCHEMBL1751884 0.76 IDO1 (0.35) MAPTCYP2C19CYP3A4CYP2C9TSHR
SCHEMBL1751885 0.76 IDO1 (0.35) MAPTCYP2C19CYP3A4CYP2C9TSHR

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-5332807-A Process of producing 8A- and 9A-azalide antibiotics MERCK & CO., INC. (US) 1994-07-26 US disclosed