SCHEMBL19684425

SCHEMBL19684425

CC(C)=C1CCCN(C2CC2)C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 5/20 0.31
L3MBTL1 Q9Y468 4/20 0.31
KDM4E B2RXH2 1/20 0.31
MBTD1 Q05BQ5 1/20 0.30
TP53BP1 Q12888 1/20 0.30
L3MBTL4 Q8NA19 1/20 0.30

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
SCHEMBL30696128 0.76 JUN (0.34) L3MBTL3L3MBTL1
SCHEMBL19836474 0.70 DRD1 (0.34)
SCHEMBL21047822 0.68 L3MBTL3 (0.37) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL16229278 0.65 CHRNA7 (0.36) L3MBTL1KDM4E
SCHEMBL21047677 0.64 MAPK1 (0.40) L3MBTL3L3MBTL1TP53BP1
SCHEMBL9832753 0.63 DRD2 (0.34)
SCHEMBL21047910 0.63 OPRM1 (0.40) L3MBTL3L3MBTL1TP53BP1
SCHEMBL21049492 0.61 OPRM1 (0.42) L3MBTL3L3MBTL1TP53BP1
SCHEMBL21047671 0.61 OPRM1 (0.42) L3MBTL3L3MBTL1TP53BP1
SCHEMBL21047702 0.61 OPRM1 (0.42) L3MBTL3L3MBTL1TP53BP1

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
WO-2017210685-A1 PYRADAZINONE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME An2H Discovery Limited (IE) 2017-12-07 WO disclosed