SCHEMBL23402195

SCHEMBL23402195

CCc1c(NC=O)c(=O)n(C(C)C)n1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.39
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
PTGS2 P35354 1/20 0.36
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 2/20 0.35
PKM P14618 1/20 0.35
LMNA P02545 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
GAA P10253 4/20 0.34
MEN1 O00255 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.33
FPR1 P21462 1/20 0.32

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
SCHEMBL23400672 0.85 ALDH1A1 (0.43) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23401151 0.82 FPR2 (0.44) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23399907 0.82 KDM4E (0.46) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23403649 0.82 KDM4E (0.36) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23401644 0.81 FPR2 (0.38) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23403522 0.80 KDM4E (0.38) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23401217 0.79 FPR2 (0.39) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23402894 0.79 FPR2 (0.39) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23402763 0.79 ALDH1A1 (0.41) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2
SCHEMBL23402932 0.79 FPR2 (0.37) FPR2KDM4ECYP1A2CYP2D6SMN1; SMN2

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed