SCHEMBL5080899

SCHEMBL5080899

CC(C)CC(CO[Si](C)(C)CCc1ccccc1)(CO[Si](C)(C)CCc1ccccc1)CC(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SIGMAR1 Q99720 7/20 0.35
AOC3 Q16853 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 2/20 0.32

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
SCHEMBL5078344 0.94 NPC1 (0.33) NPC1RAB9AMAPK1SMN1; SMN2SIGMAR1
SCHEMBL5078398 0.92 ALDH1A1 (0.33) NPC1RAB9AMAPK1SMN1; SMN2SIGMAR1
SCHEMBL5080791 0.90 NPC1 (0.32) NPC1RAB9AMAPK1SMN1; SMN2SIGMAR1
SCHEMBL5081838 0.84 SIGMAR1 (0.33) SMN1; SMN2SIGMAR1AOC3LMNA
SCHEMBL5081735 0.83 TAAR1 (0.36) NPC1RAB9ASMN1; SMN2LMNAHPGD
SCHEMBL5077729 0.79 TAAR1 (0.30) SIGMAR1
SCHEMBL5085393 0.79 TDP1 (0.38) NPC1RAB9AMAPK1SMN1; SMN2KMT2A
SCHEMBL8430157 0.79 POLB (0.39) NPC1RAB9AMAPK1KMT2AMEN1
SCHEMBL5075137 0.78 L3MBTL1 (0.34) NPC1RAB9ASMN1; SMN2LMNAHPGD
SCHEMBL5078722 0.77 ALDH1A1 (0.31) SIGMAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7323431-B2 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-01-29 US claimed
US-20060142146-A1 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION 2006-06-29 US claimed
US-7323431-B2 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-01-29 US disclosed
US-20060142146-A1 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION 2006-06-29 US disclosed