SCHEMBL30748602

SCHEMBL30748602

FC1(F)CCN(c2nccc3ccncc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.44
HRH4 Q9H3N8 1/20 0.43
HTR2C P28335 1/20 0.43
GSK3B P49841 5/20 0.42
GSK3A P49840 3/20 0.42
GRIA1 P42261 1/20 0.40
PDE10A Q9Y233 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
SORD Q00796 2/20 0.38
CNR2 P34972 1/20 0.37
MAPT P10636 2/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL30748617 0.80 GSK3A (0.39) GRM4GSK3BGSK3ACNR2MAOB
SCHEMBL26650593 0.80 GSK3A (0.39) GRM4GSK3BGSK3ACNR2MAOB
SCHEMBL3690677 0.78 HTR2C (0.69) HTR2C
SCHEMBL30748580 0.78 GRM4 (0.41) GRM4GSK3BGSK3AGRIA1PDE10A
SCHEMBL31219663 0.77 GRM4 (0.43) GRM4HRH4HTR2CGSK3AGRIA1
SCHEMBL26650750 0.75 GSK3A (0.43) GSK3BGSK3ACNR2
SCHEMBL31373518 0.75 GSK3A (0.43) GSK3BGSK3ACNR2
SCHEMBL30600701 0.74 GRM4 (0.52) GRM4HRH4HTR2CGRIA1PDE10A
SCHEMBL17583291 0.71 SCN10A (0.40) GRM4GSK3BGSK3AGRIA1PDE10A
SCHEMBL12327159 0.71 PIM1 (0.43) GRM4GSK3BGSK3A

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