SCHEMBL18754102

SCHEMBL18754102

Cc1cnc2c(n1)N(C)CC(=O)N2

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.42
MTOR P42345 15/20 0.37
PIK3CA P42336 8/20 0.37
RPTOR Q8N122 9/20 0.37
MLST8 Q9BVC4 9/20 0.37
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
RICTOR Q6R327 2/20 0.32
MAPKAP1 Q9BPZ7 2/20 0.32
CSF1R P07333 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 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
SCHEMBL27392472 0.73 MEN1 (0.44) CRBNCYP11B1CYP11B2MEN1KMT2A
SCHEMBL135934 0.72 MTOR (0.65) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL12232733 0.72 CRBN (0.41) CRBNMTORPIK3CACYP11B1CYP11B2
SCHEMBL25462260 0.72 CRBN (0.41) CRBNMTORPIK3CACYP11B1CYP11B2
SCHEMBL25462578 0.72 CRBN (0.41) CRBNCYP11B1CYP11B2MEN1KMT2A
SCHEMBL23889656 0.72 MEN1 (0.33) MEN1KMT2A
SCHEMBL135898 0.72 MTOR (0.73) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL5847527 0.70 CRBN (0.42) CRBNMTORRPTORMLST8CYP11B1
SCHEMBL17813469 0.69 MEN1 (0.44) MEN1KMT2A
SCHEMBL12394683 0.68 KDR (0.40) CRBNCSF1RMEN1KMT2AALDH1A1

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-2457913-B1 Heteroaryl compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARM LLC (US) 2017-04-19 EP disclosed