SCHEMBL18936249

SCHEMBL18936249

CCOC(=O)NC[C@H](O)CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 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
SCHEMBL18936250 1.00 MEN1 (0.34) MEN1GAAKMT2AADRB2ADRB1
SCHEMBL15791723 0.91 NPC1 (0.34) MEN1GAAKMT2AADRB2ADRB1
SCHEMBL15791722 0.91 NPC1 (0.34) MEN1GAAKMT2AADRB2ADRB1
SCHEMBL17709434 0.85 CYP2D6 (0.36) ADRB2ADRB1ADRB3
SCHEMBL16711537 0.84 MEN1 (0.40) MEN1GAAKMT2ALMNA
SCHEMBL15528058 0.76 RAB9A (0.42) ADRB2ADRB1ADRB3NPC1RAB9A
SCHEMBL6625123 0.74 POLB (0.41) MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL16709051 0.73 TSHR (0.30)
SCHEMBL14365667 0.73 TSHR (0.30)
SCHEMBL28627606 0.72

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-2986607-B1 ANTIBACTERIAL BIAROMATIC DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2017-06-14 EP disclosed