SCHEMBL31411073

SCHEMBL31411073

CC(CCO[Si](C)(C)C(C)(C)C)OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 1/20 0.35
IDO1 P14902 1/20 0.34
HTT P42858 3/20 0.33
TSHR P16473 2/20 0.33
AGXT P21549 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 1/20 0.33
DUT P33316 2/20 0.32
RCE1 Q9Y256 1/20 0.32
ATM Q13315 1/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32

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
SCHEMBL27032528 0.92 DUT (0.37) BTN3A1IDO1HTTTSHRAGXT
SCHEMBL27131617 0.92 DUT (0.37) BTN3A1IDO1HTTTSHRAGXT
SCHEMBL3405682 0.84 RXRA (0.41) ALDH1A1MAPK1
SCHEMBL6937584 0.83 HTT (0.40) BTN3A1HTTTSHRALDH1A1LMNA
SCHEMBL27032394 0.82 DUT (0.34) BTN3A1TSHRMAPTDUT
SCHEMBL27031959 0.82 DUT (0.34) BTN3A1TSHRMAPTDUT
SCHEMBL27144527 0.82 DUT (0.34) BTN3A1TSHRMAPTDUT
SCHEMBL23867732 0.81 BTN3A1 (0.36) BTN3A1RCE1
SCHEMBL4197217 0.80 ALDH1A1 (0.39) BTN3A1ALDH1A1MAPTATMMEN1
SCHEMBL21727777 0.78 MAPT (0.33) BTN3A1MAPTRCE1MEN1CYP1A2

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
CN-119954801-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-05-09 CN disclosed
CN-114867727-B TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-02-21 CN disclosed