SCHEMBL9159587

SCHEMBL9159587

CCCCCCCCCCCCCCCCOc1ccc(OCC(=O)OC)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
ALDH1A1 P00352 1/20 0.62
KMT2A Q03164 1/20 0.62
PLA2G4B P0C869 8/20 0.61
PLA2G4A P47712 1/20 0.61
TP53 P04637 1/20 0.61
TSHR P16473 1/20 0.61
PPARD Q03181 1/20 0.60
NR5A1 Q13285 1/20 0.59
RARB P10826 3/20 0.56

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
SCHEMBL15145792 0.95 PPARD (0.65) MEN1ALDH1A1KMT2APLA2G4BPLA2G4A
SCHEMBL810018 0.87 PPARD (0.53) MEN1ALDH1A1KMT2APLA2G4BPPARD
SCHEMBL10961443 0.85 TP53 (0.60) PLA2G4BPLA2G4ATP53TSHRRARB
SCHEMBL31473503 0.84 PLA2G4B (0.63) ALDH1A1PLA2G4BTP53TSHRNR5A1
SCHEMBL10757136 0.84 PLA2G4B (0.63) ALDH1A1PLA2G4BTP53TSHRNR5A1
SCHEMBL12869161 0.84 ALDH1A1 (0.63) MEN1ALDH1A1KMT2APLA2G4APPARD
SCHEMBL9160866 0.84 PLA2G4B (0.63) ALDH1A1PLA2G4BTP53TSHRNR5A1
SCHEMBL14125946 0.84 PLA2G4B (0.63) ALDH1A1PLA2G4BTP53TSHRNR5A1
SCHEMBL7280156 0.84 PLA2G4B (0.63) ALDH1A1PLA2G4BTP53TSHRNR5A1
SCHEMBL2632219 0.84 PLA2G4B (0.63) ALDH1A1PLA2G4BTP53TSHRNR5A1

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-5432189-A Bis-aryl amide and urea antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1995-07-11 US disclosed
US-5350759-A Bis-aryl urea compounds WISSNER ALLAN (US) 1994-09-27 US disclosed
US-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed
US-5231182-A Platelet activating factor inhibitor AMERICAN CYANAMID COMPANY (US) 1993-07-27 US disclosed
US-5225425-A Respiratory system disorders AMERICAN CYANAMID COMPANY (US) 1993-07-06 US disclosed
US-5208247-A Antianaphylactic agents or septic shock AMERICAN CYANAMID COMPANY (US) 1993-05-04 US disclosed
EP-0530444-A1 Aryl, amide, imide, and carbamate pyridine antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1993-03-10 EP disclosed
US-5128351-A BIS-ARYL AMIDE AND UREA ANTAGONISTS OF PLATELET ACTIVATING FACTOR AMERICAN CYANAMID COMPANY (US) 1992-07-07 US disclosed
US-5077409-A Reducing hydroxy bis-aryl amide, acylating, hydrolyzing, sulfonating, halogenating, alkylating with nitrogen heterocycle AMERICAN CYANAMID COMPANY (US) 1991-12-31 US disclosed
EP-0458037-A1 Bis-aryl amide and urea antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1991-11-27 EP disclosed