SCHEMBL9425840

SCHEMBL9425840

CCCCCCC(=O)NCCOCCO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.59
FAAH O00519 4/20 0.57
DNM1 Q05193 2/20 0.57
SELP P16109 1/20 0.55
CNR1 P21554 3/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 2/20 0.54
MEN1 O00255 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
TRPV1 Q8NER1 1/20 0.54
ALOX12 P18054 1/20 0.54
BLM P54132 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
CNR2 P34972 1/20 0.53
CASP2 P42575 1/20 0.53
ENPP2 Q13822 1/20 0.52
LPAR1 Q92633 1/20 0.52
LPAR2 Q9HBW0 1/20 0.52
THRB P10828 1/20 0.52

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
SCHEMBL12245384 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL19417124 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL12942436 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL399954 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL14065637 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL12836915 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL17817134 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL3495212 1.00 NAAA (0.59) NAAAFAAHDNM1SELPCNR1
SCHEMBL23193936 0.98 NAAA (0.57) NAAAFAAHDNM1SELPCNR1
SCHEMBL10579388 0.98 NAAA (0.57) NAAAFAAHDNM1SELPCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5358946-A Heterocycle-substituted amides, carbamates and ureas as agents for the treatment of atherosclerosis THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-10-25 US disclosed
US-4814382-A HYDROXYALKYL CARBAMATE REACTIVE DILUENTS, FILMS UNION CARBIDE CORPORATION (US) 1989-03-21 US disclosed
EP-0285650-A1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS. UNION CARBIDE CORP (US) 1988-10-12 EP disclosed
WO-1988002766-A1 SOLVENT BORNE HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1988-04-21 WO disclosed