SCHEMBL855016

SCHEMBL855016

O=C1OC(=O)c2cc(Cl)c(F)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
ALOX15 P16050 1/20 0.39
TYMS P04818 2/20 0.38
ALDH1A1 P00352 3/20 0.34
ALPL P05186 3/20 0.34
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
SLC40A1 Q9NP59 1/20 0.33
NOTUM Q6P988 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33

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
SCHEMBL29441718 0.83 ALOX15 (0.48) TDP1ALOX15TYMSALDH1A1GABRP
SCHEMBL652925 0.83 ALOX15 (0.48) TDP1ALOX15TYMSALDH1A1GABRP
SCHEMBL79833 0.83 ALOX15 (0.48) TDP1ALOX15TYMSALDH1A1TSHR
SCHEMBL9469215 0.79 TYMS (0.32) TDP1ALOX15TYMS
SCHEMBL11350152 0.73 GRIN2D (0.42) TDP1ALOX15TYMSALDH1A1
SCHEMBL13104456 0.73 GPR3 (0.40) TDP1ALOX15TYMSALDH1A1PTGS2
SCHEMBL854455 0.73 ALOX15 (0.39) TDP1ALOX15TYMSALDH1A1GABRP
SCHEMBL8329814 0.73 ALOX15 (0.39) TDP1ALOX15TYMSALDH1A1TSHR
SCHEMBL853556 0.72 ALDH1A1 (0.48) TDP1ALOX15TYMSALDH1A1GABRP
SCHEMBL4924952 0.72 ALDH1A1 (0.38) TDP1ALOX15TYMSALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604221-B2 Production method of halogen-substituted phthalide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-12-10 US disclosed
US-20120142946-A1 PRODUCTION METHOD OF HALOGEN-SUBSTITUTED PHTHALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-07 US disclosed
EP-2433933-A1 PRODUCTION METHOD OF HALOGEN-SUBSTITUTED PHTHALIDE Sumitomo Chemical Company, Limited (JP) 2012-03-28 EP disclosed
US-5185451-A Bis-imides of dioxydiphthalic acid OCCIDENTAL CHEMICAL CORPORATION (US) 1993-02-09 US disclosed
US-5166404-A Dioxydiphthalic acid esters OCCIDENTAL CHEMICAL CORPORATION (US) 1992-11-24 US disclosed
US-5101006-A Polyimides and copolyimides based on halo-oxydiphthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1992-03-31 US disclosed
US-5089631-A Intermediate for polyimides OCCIDENTAL CHEMICAL CORPORATION (US) 1992-02-18 US disclosed
US-5003086-A Etherification, dehalogenation, cyclization of dihalophthalic anhydride to form monomers for polyimides OCCIDENTAL CHEMICAL CORPORATION (US) 1991-03-26 US disclosed
EP-0398206-A1 Dioxydiphthalic anhydride OCCIDENTAL CHEMICAL CORPORATION (US) 1990-11-22 EP disclosed
US-4943642-A POLYMER INTERMEDIATES, CURING AGENTS OCCIDENTAL CHEMICAL CORPORATION (US) 1990-07-24 US disclosed