SCHEMBL8533602

SCHEMBL8533602

O=C1OC(=O)C2CC(Cl)=CCC12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
POLB P06746 5/20 0.46
TDP1 Q9NUW8 5/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
RECQL P46063 3/20 0.46
HPGD P15428 2/20 0.46
ESR1 P03372 1/20 0.46
BLM P54132 1/20 0.46
FNTA P49354 3/20 0.45
PGGT1B P53609 2/20 0.45
CASP1 P29466 5/20 0.43
CASP7 P55210 5/20 0.43
ALOX12 P18054 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
APEX1 P27695 2/20 0.40
HTT P42858 1/20 0.39
FNTB P49356 1/20 0.39

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
SCHEMBL354462 0.75 FNTA (0.49) ALDH1A1POLBTDP1MEN1KMT2A
SCHEMBL2265747 0.75 FNTA (0.49) ALDH1A1POLBTDP1MEN1KMT2A
SCHEMBL9450249 0.75 FNTA (0.45) FNTAPGGT1BFNTB
SCHEMBL9450396 0.75 FNTA (0.45) FNTAPGGT1BFNTB
SCHEMBL2265750 0.75 FNTA (0.49) ALDH1A1POLBTDP1MEN1KMT2A
SCHEMBL23504250 0.75 FNTA (0.45) FNTAPGGT1BFNTB
SCHEMBL9580647 0.73 FNTA (0.44) FNTAPGGT1BFNTB
SCHEMBL9450314 0.72 FNTA (0.33) TDP1FNTAPGGT1BSMN1; SMN2LMNA
SCHEMBL9563129 0.71 FNTA (0.45) ALDH1A1POLBTDP1MEN1KMT2A
SCHEMBL9252461 0.71 FNTA (0.60) ALDH1A1FNTAPGGT1BSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5003088-A Method for the preparation of halophthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1991-03-26 US claimed
EP-1599438-B1 PREPARATION OF SUBSTITUTED PHTHALIC ANHYDRIDE, ESPECIALLY 4-CHLOROPHTALIC ANHYDRIDE GEN ELECTRIC (US) 2008-01-09 EP disclosed
EP-0847991-A1 Method for the preparation of N-(carboxyalkyl) imides DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-06-17 EP disclosed
EP-0330219-B1 Preparation of substituted phthalic anhydride OCCIDENTAL CHEM CO (US) 1993-12-29 EP disclosed
US-5233054-A Dehydrogenating, brominating the halogen substituted hexa- or tetra-hydrophthalic anhydride in the presence of free radical catalysts OCCIDENTAL CHEMICAL CORPORATION (US) 1993-08-03 US disclosed
US-5206391-A Reacting BR2 with halohydrophthalic anhydride, reacting HBR with CL2 to regenerate bromine OCCIDENTAL CHEMICAL CORPORATION (US) 1993-04-27 US disclosed
US-5049682-A Halogenation OCCIDENTAL CHEMICAL CORPORATION (US) 1991-09-17 US disclosed
US-5003088-A Method for the preparation of halophthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1991-03-26 US disclosed
EP-0417691-A2 Process for the preparation of halophthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1991-03-20 EP disclosed
US-4978760-A Preparation of halogen substituted phthalic anhydride OCCIDENTAL CHEMICAL CORPORATION (US) 1990-12-18 US disclosed
EP-0338215-A2 Process for the preparation of halogen-substituted phthalic anhydride OCCIDENTAL CHEMICAL CORPORATION (US) 1989-10-25 EP disclosed
EP-0334049-A2 Process for the preparation of halogen-substituted phthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1989-09-27 EP disclosed
EP-0330219-A2 Preparation of substituted phthalic anhydride OCCIDENTAL CHEMICAL CORPORATION (US) 1989-08-30 EP disclosed