SCHEMBL46394

SCHEMBL46394

CON1CCC(N)(N(O)C(=O)Cc2cc(C)ccc2C)CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 1/20 0.34
POLB P06746 1/20 0.34
MAPK8 P45983 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 1/20 0.33
PAX8 Q06710 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
FPR3 P25089 1/20 0.32
FPR2 P25090 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 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
SCHEMBL46058 0.89 KDM4E (0.34) COMTPOLBMAPK8KMT2AMEN1
SCHEMBL12574766 0.87 COMT (0.33) COMTPOLBMAPK8KMT2AMEN1
SCHEMBL16456945 0.85 FFAR4 (0.34) COMTPOLBMAPK8KMT2AMEN1
SCHEMBL37524 0.84 OPRM1 (0.33) POLBMAPK8KMT2AMEN1SMN1; SMN2
SCHEMBL37478 0.84 MAPK8 (0.36) COMTPOLBMAPK8KMT2AMEN1
SCHEMBL12574770 0.82 RAB9A (0.34) KMT2AMAPTKDM4EALDH1A1HTT
SCHEMBL19139664 0.81 POLB (0.35) COMTPOLBMAPK8KMT2AMEN1
SCHEMBL46336 0.80 MAPT (0.35) COMTKMT2AMEN1MAPTALDH1A1
SCHEMBL13884156 0.79 MAPK8 (0.39) COMTPOLBMAPK8KMT2AMEN1
SCHEMBL19956367 0.78 KMT2A (0.33) POLBMAPK8KMT2AMEN1FFAR4

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-2011151249-A2 METHOD OF CONTROLLING NEONICOTINOID RESISTANT HEMIPTERA SYNGENTA PARTICIPATIONS AG (CH) 2011-12-08 WO disclosed
WO-2010063670-A1 SPIROHETEROCYCLIC N-OXYAMIDES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-06-10 WO disclosed