SCHEMBL7528419

SCHEMBL7528419

CC[Si](CC)(CC)OC(CI)c1ccc(Cl)c(N(Cc2ccccc2)S(C)(=O)=O)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
TRPM8 Q7Z2W7 5/20 0.37
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.34
GRM2 Q14416 1/20 0.33

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
SCHEMBL7528415 1.00 ALDH1A1 (0.37) ALDH1A1TRPM8TP53POLBL3MBTL1
SCHEMBL7531409 0.88 ALDH1A1 (0.37) ALDH1A1TRPM8L3MBTL1GRM2
SCHEMBL7531404 0.88 ALDH1A1 (0.37) ALDH1A1TRPM8L3MBTL1GRM2
SCHEMBL7530567 0.85 L3MBTL1 (0.38) ALDH1A1L3MBTL1GRM2
SCHEMBL7530324 0.85 L3MBTL1 (0.38) ALDH1A1L3MBTL1GRM2
SCHEMBL7531295 0.82 GRM2 (0.46) ALDH1A1POLBMEN1KMT2AGRM2
SCHEMBL7531291 0.82 GRM2 (0.46) ALDH1A1POLBMEN1KMT2AGRM2
SCHEMBL178182 0.75 KCNH2 (0.36) ALDH1A1TRPM8POLBMEN1KMT2A
SCHEMBL27555237 0.75 MEN1 (0.44) ALDH1A1TP53POLBL3MBTL1MEN1
SCHEMBL7533145 0.74 MEN1 (0.46) ALDH1A1TP53POLBL3MBTL1MEN1

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
EP-1195371-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC AMINO ALCOHOL DERIVATIVES Asahi Kasei Kabushiki Kaisha (JP) 2002-04-10 EP disclosed