SCHEMBL4185219

SCHEMBL4185219

CC(=O)OC(OC(C)=O)c1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP1A2 P05177 1/20 0.46
HPGD P15428 2/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC6A4 P31645 1/20 0.41
CTSG P08311 1/20 0.40
ACP3 P15309 1/20 0.40
CMA1 P23946 1/20 0.40
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
PGR P06401 1/20 0.40
PTGS1 P23219 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
SCHEMBL11462986 0.85 ALDH1A1 (0.44) ALDH1A1CYP2C19CYP1A2HPGDMAPT
SCHEMBL7515731 0.84 ALDH1A1 (0.44) ALDH1A1CYP2C9CYP2C19CYP1A2HPGD
SCHEMBL4837342 0.83 ALDH1A1 (0.43) ALDH1A1CYP2C9CYP2C19CYP1A2HPGD
SCHEMBL9685971 0.82 CYP1A2 (0.46) ALDH1A1CYP1A2HPGDMAPTGAA
SCHEMBL16002841 0.80 ALDH1A1 (0.49) ALDH1A1CYP2C9CYP2C19CYP1A2HPGD
SCHEMBL12335334 0.76 KDM4E (0.45) CYP2C9KMT2A
SCHEMBL1667040 0.76 ALDH1A1 (0.50) ALDH1A1CYP2C9CYP2C19CYP1A2HPGD
SCHEMBL1639926 0.76 ALDH1A1 (0.41) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL544302 0.76 GABRA1 (0.48) ALDH1A1MAPTHTTGAALMNA
SCHEMBL6424790 0.76 ALDH1A1 (0.50) ALDH1A1CYP2C9CYP2C19CYP1A2HPGD

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 8 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
CN-1656177-A Fire retardant resin composition, method of its production, shaped articles comprising the same, and silica NIPPON CATALYTIC CHEM IND (JP) 2005-08-17 CN 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
US-5122442-A Water soluble binder; photosensitive compound HOECHST CELANESE CORPORATION (US) 1992-06-16 US disclosed
US-4436804-A Light-sensitive polymeric diazonium condensates and reproduction compositions and materials therewith AMERICAN HOECHST CORPORATION (US) 1984-03-13 US disclosed
US-4207224-A Plastics composition CIBA-GEIGY AG (CH) 1980-06-10 US disclosed