SCHEMBL2154273

SCHEMBL2154273

Brc1ccccc1-c1[c]cccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 3/20 0.44
IDO1 P14902 1/20 0.38
LMNA P02545 1/20 0.38
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
HSD17B10 Q99714 1/20 0.37
PBRM1 Q86U86 1/20 0.34
MAPT P10636 3/20 0.33
HPGD P15428 2/20 0.33
DCUN1D1 Q96GG9 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MPI P34949 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RAB9A P51151 3/20 0.32
TP53 P04637 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 2/20 0.32

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
SCHEMBL2761711 0.83 MEN1 (0.32) ALDH1A1MAPK1LMNAMAOAMAPT
SCHEMBL322239 0.80 MEN1 (0.35) ALDH1A1MAPK1LMNAMAOAHSD17B10
SCHEMBL8855149 0.80 MEN1 (0.35) ALDH1A1MAPK1LMNAMAOAHSD17B10
SCHEMBL11552312 0.74
SCHEMBL115447 0.74 CYP3A4 (0.33) SMN1; SMN2
SCHEMBL27797019 0.74
SCHEMBL2225126 0.74 ALDH1A1 (0.38) ALDH1A1MAPK1IDO1LMNAMAOA
SCHEMBL4808960 0.74 TRIM24 (0.36) LMNAMAPTKDM4EGAATDP1
SCHEMBL8662652 0.74 MAPK1 (0.38) ALDH1A1MAPK1IDO1MAOAMAOB
SCHEMBL9729872 0.73

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 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513064-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING BIOFILMS Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) 2012-10-24 EP claimed
WO-2011080132-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING BIOFILMS KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2011-07-07 WO claimed
CN-117304000-A Preparation method of 2-substituted triphenylene derivative 濮阳惠成电子材料股份有限公司 2023-12-29 CN disclosed
CN-109715635-B Siloxane monomers, polymerization and use thereof 英克伦股份有限公司 2022-04-26 CN disclosed
CN-102385248-B Photosensitive polymer combination SUMITOMO CHEMICAL CO., LTD. (JP) 2016-12-14 CN disclosed
CN-102093514-B Resin combination and display device 住友化学株式会社 2016-11-16 CN disclosed
CN-105693586-A Process for preparing 1-trifluoromethyl-3-sulfonyl-methyl-pyrrole derivative 中国科学院大连化学物理研究所 2016-06-22 CN disclosed
EP-3016952-A1 SPIRO-CONDENSED LACTAM COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2016-05-11 EP disclosed
CN-102336873-B Curable resin composition SUMITOMO CHEMICAL CO 2015-03-11 CN disclosed
EP-2841429-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES Sumitomo Chemical Company Limited (JP) 2015-03-04 EP disclosed
WO-2015000542-A1 SPIRO-CONDENSED LACTAM COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-01-08 WO disclosed
US-4401455-A REACTING AN N-DIARYLPHOSPHONOMETHYL GLYCINE ESTER WITH AN ALKYL SULFENYL CHLORIDE; POSTEMERGENCE HERBICIDES MONSANTO COMPANY (US) 1983-08-30 US disclosed
US-4401604-A Process for preparing thiosulfenamide derivatives of N-phosphonomethylglycine triesters MONSANTO COMPANY (US) 1983-08-30 US disclosed
US-4395374-A HERBICIDES, PLANT GROWTH REGULATORS MONSANTO COMPANY (US) 1983-07-26 US disclosed
US-4395276-A Thiosulfenamide derivatives of N-phosphonomethylglycinonitriles as herbicides MONSANTO COMPANY (US) 1983-07-26 US disclosed
EP-0055925-A2 Alkyl N-arylsulfenyl-N-diaryloxy-phosphinylmethylglycinates and their use as herbicides MONSANTO COMPANY (US) 1982-07-14 EP disclosed
US-4300943-A Ester derivatives of N-arylthio-N-phosphonomethylglycinonitrile MONSANTO COMPANY (US) 1981-11-17 US disclosed
US-4252554-A Herbicidal ester derivatives of N-arylthio-N-phosphonomethylglycinonitrile MONSANTO COMPANY (US) 1981-02-24 US disclosed
US-3966697-A CATALYST OF COBALT COMPOUND, ORGANOALUMINUM HALIDE, PHOSPHITE, H-ACIDIC COMPOUND CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DT) 1976-06-29 US disclosed
US-3959277-A Diimidazopyrazines and tetracarboxamidopyrazines E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-05-25 US disclosed