SCHEMBL6151855

SCHEMBL6151855

CC[Ti](CC)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
PSIP1 O75475 1/20 0.35
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33
AOC3 Q16853 1/20 0.33
MAOB P27338 1/20 0.33
ATM Q13315 1/20 0.32
KCNN4 O15554 1/20 0.32
CALM1 P0DP23 1/20 0.32
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
LTA4H P09960 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15453497 0.69 LTA4H (0.35) TP53PSIP1TSHRGLAL3MBTL1
SCHEMBL31589791 0.69 CALM1 (0.43) TP53TSHRALOX12MAOBCALM1
SCHEMBL6151854 0.65 LTA4H (0.37) TP53PSIP1LMNATSHRGLA
SCHEMBL27602220 0.65 PTGS2 (0.43) ALDH1A1MEN1KMT2A
SCHEMBL959288 0.65 LTA4H (0.37) TP53PSIP1TSHRACHEGLA
SCHEMBL6151849 0.65 TSHR (0.39) TP53LMNATSHRALOX12ACHE
SCHEMBL5531479 0.64 LTA4H (0.35) TP53PSIP1TSHRGLAL3MBTL1
SCHEMBL392642 0.63 ALDH1A1 (0.40) LMNATSHRALOX12ACHEKCNN4
Biphenyl SCHEMBL323849 0.60 ALDH1A1 (0.69) TP53LMNATSHRATML3MBTL1
Butane SCHEMBL15105003 0.59 PTGS2 (0.48) TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050153145-A1 Makes adhesion, printing, coating, or the like on the solid surface easy without directly using a flame treatment YAMASHITA MIKIO (JP) 2005-07-14 US disclosed
EP-1538234-A2 Method of modifying solid surface and product obtained Yasuhiro, Mori (JP) 2005-06-08 EP disclosed