SCHEMBL4083377

SCHEMBL4083377

CC(c1ccccc1)N1CC=C(c2ccc(OCc3ccccc3)cc2)C(O[Si](C(C)C)(C(C)C)C(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 1/20 0.46
CHRM4 P08173 1/20 0.42
PRMT5 O14744 4/20 0.38
BCHE P06276 2/20 0.37
ALOX5 P09917 2/20 0.37
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ACACB O00763 1/20 0.36
BCL2 P10415 1/20 0.36
MDM2 Q00987 1/20 0.36
MCL1 Q07820 1/20 0.36

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
SCHEMBL2682972 1.00 FDFT1 (0.46) FDFT1CHRM4PRMT5BCHEALOX5
SCHEMBL4083380 1.00 FDFT1 (0.46) FDFT1CHRM4PRMT5BCHEALOX5
SCHEMBL6622776 0.87 FDFT1 (0.44) FDFT1CHRM4BCHEALOX5NPC1
SCHEMBL8218213 0.84 FDFT1 (0.47) FDFT1CHRM4BCHEALOX5NPC1
SCHEMBL1941467 0.84 FDFT1 (0.47) FDFT1CHRM4BCHEALOX5NPC1
SCHEMBL8218218 0.84 FDFT1 (0.47) FDFT1CHRM4BCHEALOX5NPC1
SCHEMBL4602100 0.76 HRH3 (0.49) FDFT1CHRM4PRMT5BCHENPC1
SCHEMBL4602103 0.76 HRH3 (0.49) FDFT1CHRM4PRMT5BCHENPC1
SCHEMBL2683449 0.73 CHRM4 (0.42) CHRM4BCHEALOX5NPC1RAB9A
SCHEMBL2338156 0.73 CHRM4 (0.42) CHRM4BCHEALOX5NPC1RAB9A

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-2018862-A1 Substituted piperidines as therapeutic compounds Speedel Experimenta AG (CH) 2009-01-28 EP disclosed