SCHEMBL8622940

SCHEMBL8622940

CC(C)(C)[Si](C)(C)OCCCCCCCCCCCCCCCCCCCCCCO

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DUT P33316 2/20 0.37
LMNA P02545 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSHR P16473 1/20 0.33
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
ACHE P22303 6/20 0.31
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 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
SCHEMBL7539972 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL10930589 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL16124200 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL31399502 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL200311 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL1143253 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL25304378 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL28500270 1.00 DUT (0.37) DUTLMNAMEN1KMT2AALDH1A1
SCHEMBL334934 0.98 DUT (0.38) DUTCYP4F2CYP4A11
SCHEMBL571057 0.91 DUT (0.39) DUT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995029923-A1 PROCESS FOR THE PREPARATION OF MONO- AND BIS(PHOSPHOCHOLINE) DERIVATIVES WHICH HAVE ANTIFUNGAL ACTIVITY SHAMAN PHARMACEUTICALS, INC. (US) 1995-11-09 WO claimed
US-5811568-A PHOSPHORYLATION SHAMAN PHARMACEUTICALS, INC. (US) 1998-09-22 US disclosed
WO-1995029923-A1 PROCESS FOR THE PREPARATION OF MONO- AND BIS(PHOSPHOCHOLINE) DERIVATIVES WHICH HAVE ANTIFUNGAL ACTIVITY SHAMAN PHARMACEUTICALS, INC. (US) 1995-11-09 WO disclosed