SCHEMBL28329552

SCHEMBL28329552

CCCCCCCC/C=C\CCCCCCCC(N)CC(C)=O.[Rh]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.50
SOAT1 P35610 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
KMT2A Q03164 1/20 0.50
S1PR2 O95136 5/20 0.46
S1PR1 P21453 5/20 0.46
S1PR3 Q99500 5/20 0.46
S1PR4 O95977 4/20 0.46
KDM4E B2RXH2 2/20 0.46
TERT O14746 2/20 0.46
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46

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
SCHEMBL13675239 0.88 S1PR2 (0.52) S1PR2S1PR1S1PR3S1PR4
SCHEMBL28305103 0.88 S1PR2 (0.52) S1PR2S1PR1S1PR3S1PR4
SCHEMBL1561204 0.88 S1PR2 (0.52) S1PR2S1PR1S1PR3S1PR4
SCHEMBL7567243 0.85 TERT (0.56) FAAHCYP1A2CYP2C19KMT2AS1PR2
SCHEMBL11431501 0.85 TERT (0.56) FAAHCYP1A2CYP2C19KMT2AS1PR2
SCHEMBL29100430 0.85 FAAH (0.61) FAAHSOAT1CYP1A2CYP2C19MEN1
SCHEMBL28876565 0.84 TERT (0.54) FAAHCYP1A2CYP2C19KMT2AS1PR2
Silver SCHEMBL28211250 0.83 FABP3 (0.56) FAAHSOAT1CYP1A2CYP2C19MEN1
SCHEMBL25754164 0.80 CA2 (0.43) S1PR2S1PR1S1PR3S1PR4
SCHEMBL6874674 0.80 CA2 (0.43) S1PR2S1PR1S1PR3S1PR4

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
CN-110449184-A Hydrogenate the preparation method and applications of palladium nano sheet UNIV JILIN 2019-11-15 CN claimed