SCHEMBL17081990

SCHEMBL17081990

Cc1ccccc1N1CC[C@@]2(CCCN(c3nccnc3C#N)C2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 9/20 0.40
MAPT P10636 1/20 0.38
KCNJ1 P48048 1/20 0.37
MALT1 Q9UDY8 1/20 0.36
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
HCRTR2 O43614 1/20 0.33
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TRPV4 Q9HBA0 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
SCHEMBL550677 1.00 EGLN1 (0.40) EGLN1MAPTKCNJ1MALT1DDB1
SCHEMBL549480 0.85 MALT1 (0.41) EGLN1MAPTMALT1DDB1CRBN
SCHEMBL17081994 0.85 MALT1 (0.41) EGLN1MAPTMALT1DDB1CRBN
SCHEMBL4570093 0.82 EGLN1 (0.38) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL4570053 0.79 MALT1 (0.52) EGLN1MALT1
SCHEMBL2699628 0.76 DRD2 (0.46) EGLN1MAPTMALT1
SCHEMBL2699735 0.76 DRD2 (0.46) EGLN1MAPTMALT1
SCHEMBL550621 0.76 DRD2 (0.46) EGLN1MAPTMALT1
SCHEMBL549652 0.75 EGLN1 (0.38) EGLN1MAPTMALT1DDB1CRBN
SCHEMBL17081991 0.75 EGLN1 (0.38) EGLN1MAPTMALT1DDB1CRBN

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-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed