SCHEMBL22306887

SCHEMBL22306887

Bc1cn(C)c(=O)c2c1CCNC2

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
PNMT P11086 2/20 0.33
HTR2C P28335 2/20 0.33
MEN1 O00255 1/20 0.33
GABRA1 P14867 1/20 0.33
CYP2C19 P33261 1/20 0.33
GABRB2 P47870 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2A P28223 1/20 0.33
GMNN O75496 1/20 0.33
BLM P54132 1/20 0.33
PARP1 P09874 1/20 0.32
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL22290115 0.81 BRD4 (0.34) BRD4PNMTHTR2CMEN1GABRA1
SCHEMBL25604386 0.79 BRD4 (0.37) BRD4PNMTHTR2CMEN1GABRA1
SCHEMBL22290131 0.78 BRD4 (0.36) BRD4PNMTHTR2CMEN1GABRA1
SCHEMBL21904897 0.69 PNMT (0.42) PNMT
SCHEMBL4793244 0.69 CD44 (0.42) BRD4PNMTHTR2CMEN1GABRA1
SCHEMBL25606981 0.68 BRD4 (0.41) BRD4
SCHEMBL21363443 0.68 SRC (0.38) HTR2CSIGMAR1
SCHEMBL25607096 0.66 BRD4 (0.36) BRD4
SCHEMBL1968864 0.62 GABRA1 (0.36) PNMTHTR2CMEN1GABRA1CYP2C19
SCHEMBL9836925 0.60 PARP1 (0.41) HTR2CHTR2APARP1SIGMAR1

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-2020160196-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2020-08-06 WO disclosed