SCHEMBL5807130

SCHEMBL5807130

CC(N)=C(C)CCCCN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.50
NFKB1 P19838 2/20 0.42
CYP2D6 P10635 1/20 0.42
BLM P54132 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PLG P00747 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.40
SLC6A2 P23975 1/20 0.40
RECQL P46063 1/20 0.40
SLC6A3 Q01959 1/20 0.40
DNM1 Q05193 5/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA3 P07451 2/20 0.37

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
SCHEMBL5807128 1.00 PAOX (0.50) PAOXNFKB1CYP2D6BLMLMNA
SCHEMBL7225588 0.80 PAOX (0.52) PAOXNFKB1CYP2D6BLMLMNA
SCHEMBL4877578 0.78 SPHK2 (0.50) MEN1ALDH1A1KMT2AALOX15TSHR
Bromide SCHEMBL7861489 0.77 PAOX (0.31) PAOX
SCHEMBL3688697 0.76 SPHK2 (0.54) MEN1ALDH1A1KMT2AALOX15TSHR
SCHEMBL4875798 0.76 SPHK2 (0.54) MEN1ALDH1A1KMT2AALOX15TSHR
SCHEMBL4883237 0.76 SPHK2 (0.54) MEN1ALDH1A1KMT2AALOX15TSHR
SCHEMBL4873881 0.76 SPHK2 (0.54) MEN1ALDH1A1KMT2AALOX15TSHR
SCHEMBL4880051 0.76 SPHK2 (0.54) MEN1ALDH1A1KMT2AALOX15TSHR
SCHEMBL4883354 0.76 SPHK2 (0.54) MEN1ALDH1A1KMT2AALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006097348-A1 USE OF AGENTS SUCH AS NONPOLYMERIC NITRIC OXIDE DONORS FOR MAKING THE LIPS FULL AGAIN AND/OR COLOURING THE LIPS L'OREAL (FR) 2006-09-21 WO disclosed
WO-2006097350-A1 ANHYDROUS COSMETIC COMPOSITION CONTAINING AN AGENT FOR PROMOTING THE MICROCIRCULATION AND A POLYOL, USES THEREOF L'OREAL (FR) 2006-09-21 WO disclosed