SCHEMBL30748580

SCHEMBL30748580

FC1(F)CCN(c2nccc3cncnc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.41
GSK3A P49840 3/20 0.40
GSK3B P49841 3/20 0.40
GRIA1 P42261 1/20 0.39
PDE10A Q9Y233 1/20 0.39
FFAR2 O15552 3/20 0.37
TTK P33981 2/20 0.36
SIGMAR1 Q99720 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
SCN10A Q9Y5Y9 3/20 0.35
CNR2 P34972 1/20 0.34

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
SCHEMBL31373559 0.80 SCN10A (0.39) GSK3AGSK3BFFAR2SIGMAR1SCN10A
SCHEMBL26650908 0.80 SCN10A (0.39) GSK3AGSK3BFFAR2SIGMAR1SCN10A
SCHEMBL30600701 0.79 GRM4 (0.52) GRM4GRIA1PDE10AFFAR2MTOR
SCHEMBL30748602 0.78 GRM4 (0.44) GRM4GSK3AGSK3BGRIA1PDE10A
SCHEMBL29575286 0.77 PRKD1 (0.42) GSK3AGSK3BPDE10ATTKPIK3CA
SCHEMBL24394248 0.75 TTK (0.39) GRM4GRIA1PDE10ATTKPIK3CA
SCHEMBL26942890 0.73 TTK (0.42) GRM4FFAR2TTKSCN10A
SCHEMBL29575713 0.72 NEK2 (0.53)
SCHEMBL16711029 0.72 CYP3A4 (0.41) GSK3AGSK3BFFAR2SIGMAR1PIK3CA
SCHEMBL31219663 0.70 GRM4 (0.43) GRM4GSK3AGRIA1PDE10ATTK

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-2023217230-A1 KINESIN KIF18A INHIBITOR AND USE THEREOF 上海湃隆生物科技有限公司 2023-11-16 WO disclosed