SCHEMBL27171663

SCHEMBL27171663

CCn1ncc(-c2cc(F)nc(N)c2OC)n1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.33
CHRM3 P20309 2/20 0.33
PIK3CD O00329 3/20 0.33
PIK3CA P42336 3/20 0.33
PIK3CG P48736 3/20 0.33
TLR8 Q9NR97 1/20 0.32
FYN P06241 3/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL24823954 0.83 TYK2 (0.34) CHRM2CHRM3PIK3CDPIK3CAPIK3CG
SCHEMBL30079392 0.83 TYK2 (0.34) CHRM2CHRM3PIK3CDPIK3CAPIK3CG
SCHEMBL24823945 0.75 CHRM2 (0.34) CHRM2CHRM3FYN
SCHEMBL24823668 0.71 CHRM2 (0.35) CHRM2CHRM3MEN1MAPTKMT2A
SCHEMBL24823030 0.70 CHRM2 (0.36) CHRM2CHRM3PIK3CDPIK3CAPIK3CG
SCHEMBL24823515 0.68 TYK2 (0.34) CHRM2CHRM3PIK3CDPIK3CAPIK3CG
SCHEMBL24823950 0.66 CHRM2 (0.35) CHRM2CHRM3
SCHEMBL24823959 0.63 HSD17B10 (0.34) TLR8FYNMEN1POLBKMT2A
SCHEMBL30079422 0.63 HSD17B10 (0.34) TLR8FYNMEN1POLBKMT2A
SCHEMBL13510718 0.62 CASP3 (0.43) CHRM2CHRM3TLR8MEN1POLB

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
EP-4337655-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS Bristol-Myers Squibb Company (US) 2024-03-20 EP disclosed
WO-2022241171-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2022-11-17 WO disclosed