SCHEMBL9162002

SCHEMBL9162002

CCCCCCCCCCCCCCOc1ccc(N=C=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.54
TP53 P04637 2/20 0.53
TSHR P16473 1/20 0.53
PLA2G4B P0C869 5/20 0.51
RARB P10826 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
LTA4H P09960 3/20 0.49
PLA2G4A P47712 1/20 0.47

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
SCHEMBL7777016 1.00 NR5A1 (0.54) NR5A1TP53TSHRPLA2G4BRARB
SCHEMBL3707532 1.00 NR5A1 (0.54) NR5A1TP53TSHRPLA2G4BRARB
SCHEMBL9702597 1.00 NR5A1 (0.54) NR5A1TP53TSHRPLA2G4BRARB
SCHEMBL11848774 1.00 NR5A1 (0.54) NR5A1TP53TSHRPLA2G4BRARB
SCHEMBL1020538 1.00 NR5A1 (0.54) NR5A1TP53TSHRPLA2G4BRARB
SCHEMBL414168 0.95 CYP1A2 (0.50) NR5A1TP53TSHRRAB9ALMNA
SCHEMBL6888218 0.93 NR5A1 (0.47) NR5A1TP53TSHRPLA2G4BRARB
SCHEMBL7602206 0.91 TSHR (0.50) NR5A1TP53TSHRPLA2G4BGAA
SCHEMBL10703892 0.91 TSHR (0.50) NR5A1TP53TSHRPLA2G4BGAA
SCHEMBL7001372 0.90 CYP1A2 (0.46) NR5A1TP53TSHRRAB9ALMNA

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 7 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-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-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