SCHEMBL20194473

SCHEMBL20194473

O=CC(=O)NCc1ccc(F)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.47
MAOB P27338 1/20 0.44
EPHX2 P34913 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
PPARG P37231 2/20 0.42
NAMPT P43490 2/20 0.42
MMP13 P45452 1/20 0.41

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
SCHEMBL12784726 0.85 TGM2 (0.58) TRPV1MAOBPPARGNAMPTMMP13
SCHEMBL18415487 0.82 TRPV1 (0.48) TRPV1MAOBPPARGNAMPTMMP13
SCHEMBL3569391 0.80 P2RX7 (0.49) TRPV1MAOBEPHX2NR1H4PPARG
SCHEMBL8309696 0.79 KMT2A (0.53) MMP13
SCHEMBL2857248 0.76 CARM1 (0.39) TRPV1MAOBPPARG
SCHEMBL8343319 0.76 CACNA1G (0.39) TRPV1MAOBPPARGMMP13
SCHEMBL23564760 0.76 P2RX7 (0.46) TRPV1MAOBPPARG
SCHEMBL31565001 0.76 ALDH1A1 (0.51) TRPV1MAOBPPARG
SCHEMBL1456919 0.76 P2RX7 (0.49)
SCHEMBL4038038 0.76 ALDH1A1 (0.51) TRPV1MAOBPPARG

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-3326715-A1 OXALIC ACID MONOAMIDE LIGAND, AND USES THEREOF IN COUPLING REACTION OF COPPER-CATALYZED ARYL HALOGEN SUBSTITUTE Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2018-05-30 EP disclosed