SCHEMBL5446281

SCHEMBL5446281

CCC(CCCC(N)=O)C(N)=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.72
CA1 P00915 4/20 0.72
MAPK1 P28482 1/20 0.45
KMT2A Q03164 2/20 0.37
ALOX15 P16050 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
SOAT1 P35610 2/20 0.36
MEN1 O00255 1/20 0.36
FAAH O00519 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
SLC1A2 P43004 3/20 0.34
SLC1A1 P43005 3/20 0.34
SLC1A3 P43003 2/20 0.34
CNR1 P21554 1/20 0.34
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33

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
SCHEMBL9755308 0.91 CA2 (0.67) CA2CA1MAPK1KMT2ASOAT1
SCHEMBL15111428 0.91 CA2 (0.67) CA2CA1MAPK1KMT2ASOAT1
SCHEMBL25853764 0.88 CA2 (0.61) CA2CA1MAPK1KMT2AALOX15
SCHEMBL21906568 0.88 CA2 (0.61) CA2CA1MAPK1KMT2AALOX15
Palmitamide SCHEMBL28248068 0.86 CA2 (0.71) CA2CA1MAPK1KMT2ASOAT1
Octadecanoic Acid Amide SCHEMBL29144436 0.86 CA2 (0.71) CA2CA1MAPK1KMT2ASOAT1
SCHEMBL11677928 0.86 CA2 (0.55) CA2CA1MAPK1KMT2AALOX15
SCHEMBL28720471 0.84 CA2 (0.69) CA2CA1MAPK1KMT2ASOAT1
SCHEMBL9804387 0.84 CA2 (0.57) CA2CA1MAPK1KMT2ASOAT1
SCHEMBL27674258 0.84 CA2 (0.65) CA2CA1MAPK1KMT2AALOX15

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
WO-2014117099-A2 THERMOCHROMIC COLORING PAD CHROMATIC TECHNOLOGIES INC. (US) 2014-07-31 WO disclosed
US-20070131618-A1 MULTIVALENT METAL ION EXTRACTION USING DIGLYCOLAMIDE-COATED PARTICLES PG RESEARCH FOUNDATION, INC. 2007-06-14 US disclosed
US-20060135688-A1 Powder coating compositions PQ SILICAS UK LIMITED (GB) 2006-06-22 US disclosed
US-5470833-A Vasodilators, bronchodilators BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-11-28 US disclosed