SCHEMBL5081809

SCHEMBL5081809

CCC(C)(C)[SiH2]OCC(CO[SiH2]C(C)(C)CC)(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
LMNA P02545 1/20 0.38
CYP2D6 P10635 1/20 0.38
TRPA1 O75762 1/20 0.34
MMP8 P22894 2/20 0.34
TP53 P04637 1/20 0.33
CYP1A2 P05177 2/20 0.32
RECQL P46063 2/20 0.32
CYP3A4 P08684 1/20 0.32
RIPK1 Q13546 3/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
MAPK1 P28482 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
SCHEMBL5078144 0.94 SLC6A2 (0.36) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL5080808 0.93 SLC6A2 (0.35) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL5075144 0.90 SLC6A2 (0.33) SLC6A2TAAR1LMNACYP2D6
SCHEMBL5081737 0.90 SLC6A2 (0.42) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL5077364 0.84 SLC6A2 (0.36) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL5075139 0.84 SLC6A2 (0.38) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL5075138 0.82 SLC6A2 (0.34) SLC6A2TAAR1LMNACYP2D6MMP8
SCHEMBL5085403 0.77 SLC6A2 (0.44) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL5077302 0.76 SLC6A2 (0.34) SLC6A2TAAR1LMNACYP2D6MMP8
SCHEMBL3836967 0.75 SLC6A2 (0.45) SLC6A2TAAR1LMNACYP2D6TRPA1

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