SCHEMBL8522100

SCHEMBL8522100

C=Cc1ccccc1[Si](C)(C)CCCCCCCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.36
ALDH1A1 P00352 1/20 0.32
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
NAAA Q02083 3/20 0.31
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31
EGFR P00533 1/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
LIPG Q9Y5X9 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
SCHEMBL7064746 0.93 ALDH1A1 (0.34) ALDH1A1
SCHEMBL31468453 0.85 HTT (0.35) KCNH2MEN1KMT2A
SCHEMBL31468579 0.80 SIGMAR1 (0.37) KCNH2ALDH1A1TSHR
SCHEMBL30872686 0.80 ALDH1A1 (0.34) ALDH1A1
SCHEMBL31468636 0.79 HRH1 (0.34) KCNH2ALDH1A1TSHRMEN1LMNA
SCHEMBL27258709 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL31468521 0.77 HTT (0.35) KCNH2MEN1KMT2A
Hydrochloric Acid SCHEMBL27258912 0.77 ALDH1A1 (0.34) ALDH1A1
Hexane SCHEMBL10533800 0.76 ALDH1A1 (0.46) KCNH2ALDH1A1CNR1THRATHRB
SCHEMBL8192504 0.76

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-5859277-A Silicon-containing solid support linker WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-01-12 US disclosed