SCHEMBL228290

SCHEMBL228290

O=C(Cl)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.74
NR4A1 P22736 1/20 0.74
NR4A3 Q92570 1/20 0.74
MAOB P27338 1/20 0.70
PARP10 Q53GL7 1/20 0.70
SRD5A2 P31213 1/20 0.68
PLA2G4B P0C869 1/20 0.64
LMNA P02545 1/20 0.61
CYP1A2 P05177 1/20 0.61
PTGS1 P23219 1/20 0.61
SLC6A2 P23975 1/20 0.61
CYP2C19 P33261 1/20 0.61
PTGS2 P35354 1/20 0.61
SLC6A3 Q01959 1/20 0.61
HIF1A Q16665 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
PTPRC P08575 2/20 0.59
PTPN1 P18031 2/20 0.59
PTPN2 P17706 1/20 0.59
FFAR1 O14842 1/20 0.58

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
SCHEMBL8378881 0.95 NR4A2 (0.68) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL7147266 0.95 NR4A2 (0.84) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL6652096 0.85 ALOX5 (0.63) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL25686462 0.85 NR4A1 (0.55) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL6830467 0.85 NR4A2 (1.00) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL4059143 0.85 NR4A2 (1.00) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL228477 0.85 NR4A2 (1.00) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL3232949 0.85 SRD5A2 (0.90) NR4A2NR4A1NR4A3MAOBPARP10
SCHEMBL19490438 0.85 NR4A2 (0.58) NR4A2NR4A1NR4A3MAOBPARP10
Benzylphenylether SCHEMBL27549280 0.85 NR4A2 (0.67) NR4A2NR4A1NR4A3MAOBPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598756-B1 ESTER COMPOSITION SHELL INT RESEARCH (NL) 1996-06-05 EP claimed
EP-0598756-A1 ESTER COMPOSITION. SHELL INT RESEARCH (NL) 1994-06-01 EP claimed
WO-1993002038-A1 ESTER COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1993-02-04 WO claimed
JP-2167250-A None JP disclosed
JP-7126219-A None JP disclosed
JP-3011041-A None JP disclosed
JP-7228554-A None JP disclosed
JP-7228552-A None JP disclosed
JP-9059222-A None JP disclosed
JP-4117345-A None JP disclosed
JP-8268970-A None JP disclosed
US-4410696-A Antitumor and immunosuppressive 4-carbamoylimidazolium-5-olate derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-10-18 US disclosed
EP-0075629-A1 Imidazole derivatives, their preparation, and their pharmaceutical compositions Sumitomo Chemical Industries Ltd. (JP) 1983-04-06 EP disclosed
US-4369139-A PREVENTION OF CEREBRAL INSUFFICIENCY HOFFMANN-LA ROCHE INC. (US) 1983-01-18 US disclosed
EP-0046144-A1 Therapeutically active derivatives of phenylethanol amines Aktiebolaget Draco (SE) 1982-02-17 EP disclosed
EP-0005143-A1 1-Benzoyl-2-pyrrolidinone derivative, processes for its preparation and medicaments containing it F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1979-11-14 EP disclosed
US-4098816-A HYPOGLYCEMIC AGENTS AND ANTILIPEMIC AGENTS BEECHAM GROUP LIMITED (GB) 1978-07-04 US disclosed
US-3960886-A Substituted N-arylanilines STERLING DRUG INC. (US) 1976-06-01 US disclosed
US-3948939-A 9-Acyl-1,2,3,4-tetrahydrocarbazole-3 and 4-carboxylic acids STERLING DRUG INC. (US) 1976-04-06 US disclosed
JP-H00959222-A 0001-01-01 JP disclosed