SCHEMBL6092029

SCHEMBL6092029

Cc1[nH]c(C=O)c(C)c1CCCN1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.46
FGFR1 P11362 1/20 0.46
KDR P35968 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.40
LTA4H P09960 1/20 0.36
HRH1 P35367 1/20 0.36
HRH3 Q9Y5N1 3/20 0.35
SIGMAR1 Q99720 1/20 0.34
KMT2A Q03164 1/20 0.34
ALOX15 P16050 1/20 0.33
PARP1 P09874 1/20 0.33
CHEK1 O14757 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
MAPT P10636 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
SCHEMBL6089855 0.92 HRH3 (0.42) PDGFRBFGFR1KDRL3MBTL1HRH3
SCHEMBL4410704 0.87 PDGFRB (0.43) PDGFRBFGFR1KDRSIGMAR1KMT2A
SCHEMBL6092642 0.83 ALOX15 (0.42) L3MBTL1KMT2AALOX15MAPT
SCHEMBL6091353 0.81 ALOX15 (0.45) L3MBTL1KMT2AALOX15MAPT
SCHEMBL5401668 0.76 L3MBTL1 (0.45) PDGFRBFGFR1KDRL3MBTL1KMT2A
SCHEMBL6220089 0.75 SPR (0.41) MAPT
SCHEMBL6088742 0.74 KDM4E (0.46) PDGFRBFGFR1KDRKMT2ACHEK1
SCHEMBL5414923 0.72 SRC (0.44) PDGFRBFGFR1KDRLTA4HMAPT
SCHEMBL6090420 0.72 CHEK1 (0.43) PDGFRBFGFR1KDRKMT2ACHEK1
SCHEMBL6090987 0.72 CHEK1 (0.51) PDGFRBFGFR1KDRKMT2ACHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed