SCHEMBL4189748

SCHEMBL4189748

CC(=O)Oc1cccc(-c2cccc(OC(C)=O)c2C(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAPDH P04406 2/20 0.50
MAOB P27338 1/20 0.47
LMNA P02545 3/20 0.46
CYP3A4 P08684 1/20 0.46
ACHE P22303 1/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
BACE1 P56817 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ADORA2A P29274 2/20 0.41
ADORA3 P0DMS8 1/20 0.40
ADORA1 P30542 1/20 0.40
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.40
GLA P06280 1/20 0.40
RAB9A P51151 1/20 0.40
TTR P02766 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL5068601 0.85 ADORA3 (0.50) LMNAMAPTALDH1A1BACE1MEN1
SCHEMBL7037049 0.78 GAPDH (0.52) GAPDHMAOBLMNACYP3A4ACHE
SCHEMBL24313994 0.75 HTT (0.56) GAPDHLMNACYP3A4ALDH1A1BACE1
SCHEMBL28032593 0.75 LMNA (0.66) GAPDHMAOBLMNACYP3A4ACHE
SCHEMBL27999721 0.75 CYP3A4 (0.57) GAPDHMAOBLMNACYP3A4ACHE
SCHEMBL487085 0.75 RXRA (0.54) GAPDHLMNACYP3A4ACHEMAPT
SCHEMBL4188956 0.75 CYP1A2 (0.51) MAOBLMNACYP3A4ALDH1A1MEN1
SCHEMBL16710317 0.75 CTSA (0.49) GAPDHMAOBLMNACYP3A4BACE1
SCHEMBL3793282 0.74 LMNA (0.51) GAPDHMAOBLMNACYP3A4ACHE
SCHEMBL13867739 0.73 GAPDH (0.53) GAPDHMAOBLMNACYP3A4ACHE

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-7601775-B2 Fire retardant resin composition, method of its production, shaped articles comprising the same, and silica NIPPON SHOKUBAI CO., LTD. (JP) 2009-10-13 US disclosed
US-20060167164-A1 Fire retardant resin composition, method of its production, shaped articles comprising the same, and silica NIPPON SHOKUBAI CO., LTD. (JP) 2006-07-27 US disclosed
EP-1507829-A1 FIRE RETARDANT RESIN COMPOSITION, METHOD OF ITS PRODUCTION, SHAPED ARTICLES COMPRISING THE SAME, AND SILICA Nippon Shokubai Co., Ltd. (JP) 2005-02-23 EP disclosed
WO-2003099934-A1 FIRE RETARDANT RESIN COMPOSITION, METHOD OF ITS PRODUCTION, SHAPED ARTICLES COMPRISING THE SAME, AND SILICA NIPPON SHOKUBAI CO., LTD. (JP) 2003-12-04 WO disclosed