SCHEMBL7931235

SCHEMBL7931235

O=C(c1ccccc1)c1ccc(Br)c(Br)c1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
AKR1C3 P42330 2/20 0.50
MAPT P10636 4/20 0.49
POLB P06746 1/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 2/20 0.47
KDM4E B2RXH2 2/20 0.47
USP2 O75604 2/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SRD5A2 P31213 1/20 0.43
CYP2C8 P10632 1/20 0.43
CYP2C9 P11712 1/20 0.43
HSD17B10 Q99714 2/20 0.42
MAPK1 P28482 2/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL6597786 0.84 AKR1C3 (0.55) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL29683548 0.84 AKR1C3 (0.55) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL570739 0.83 AKR1C3 (0.55) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL8495472 0.82 MAPT (0.51) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL31502529 0.82 AKR1C3 (0.53) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL9295747 0.81 AKR1C3 (0.61) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL1129191 0.78 PRNP (0.59) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL30549381 0.77 MAPT (0.54) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL723657 0.77 AKR1C3 (0.61) ALDH1A1AKR1C3MAPTPOLBMEN1
SCHEMBL29913321 0.77 AKR1C3 (0.61) ALDH1A1AKR1C3MAPTPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095005-A1 PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES ALBEMARLE CORPORATION (US) 2001-05-02 EP disclosed
US-6096920-A LARGE-SCALE PRODUCTION OF CERTAIN AROMATICALLY-SUBSTITUTED ALIPHATIC CARBOXYLIC ACIDS AND THEIR ACID DERIVATIVES ALBEMARLE CORPORATION (US) 2000-08-01 US disclosed
WO-2000002840-A1 PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES ALBEMARLE CORPORATION (US) 2000-01-20 WO disclosed
WO-1999038833-A1 PROCESS FOR THE HALOGENATION OF ALDEHYDES AND KETONES BROMINE COMPOUNDS LTD. (IL) 1999-08-05 WO disclosed
US-5750631-A CURABLE EPOXIDIZED PHENOLIC RESIN CONTAINING CHLORINE AND/OR BROMINE; FIREPROOFING, BY-PRODUCT INHIBITION SHELL OIL COMPANY (US) 1998-05-12 US disclosed
EP-0293115-B1 Melt-stable poly(arylene thiotherketone) and production process thereof KUREHA CHEMICAL IND CO LTD (JP) 1997-09-17 EP disclosed
US-5378772-A Copolymerization of poly(arylene thioetherketoneketones) KUREHA KAGAKU KOGYO K.K. (JP) 1995-01-03 US disclosed
US-5378771-A Sulfiding dihalobenzene and bis(halobenzoyl)benzene in two steps to copolymerize poly(arylene thioetherketoneketones) KUREHA KAGAKU KOGYO K.K.K. (JP) 1995-01-03 US disclosed
US-5248743-A Polythioethers KUREHA KAGAKU KOGYO K.K. (JP) 1993-09-28 US disclosed
US-5153279-A Heat resistance, melt processability KUREHA KAGAKU KOGYO K.K. (JP) 1992-10-06 US disclosed
US-5153264-A Heating dihalo aromatic compound and alkali metal sulfide, mixing with dihalo aromatic carbonyl compound; organic amide and water solvent KUREHA KAGAKU KOGYO K.K. (JP) 1992-10-06 US disclosed
US-5153278-A Heat resistance, workability; materials handling; molding materials; films KUREHA KAGAKU KOGYO K.K. (JP) 1992-10-06 US disclosed
US-5120808-A Melt processability, heat resistance polyether ketone polymers KUREHA KAGAKU KOGYO K.K. (JP) 1992-06-09 US disclosed
EP-0435674-A2 High-heat-resistant, crystalline block copolymers and production process thereof KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-07-03 EP disclosed
EP-0369620-A2 Poly(arylene thioether)block copolymer and production process thereof KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-05-23 EP disclosed
US-4895925-A HEAT RESISTANT MOLDING MATERIAL KUREHA KAGAKU KOGYO K.K. (JP) 1990-01-23 US disclosed
US-4886871-A REACTING ALKALI METAL SULFIDE AND DIHALOGENATED COMPOUNDS KUREHA KAGAKU KOGYO K. K. (JP) 1989-12-12 US disclosed
EP-0293115-A2 Melt-stable poly(arylene thiotherketone) and production process thereof KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-11-30 EP disclosed