SCHEMBL31320196

SCHEMBL31320196

Cc1cc(C(=O)NN)nc(N2CCOC(C)C2)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIF18A Q8NI77 12/20 0.46
AKT1 P31749 2/20 0.44
ATM Q13315 2/20 0.41
PIK3CB P42338 4/20 0.41
PIK3CA P42336 3/20 0.41
PIK3CD O00329 3/20 0.40
PIK3CG P48736 3/20 0.40

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
SCHEMBL31320192 1.00 KIF18A (0.46) KIF18AAKT1ATMPIK3CBPIK3CA
SCHEMBL30637270 0.85 RBP4 (0.45) KIF18AAKT1ATMPIK3CDPIK3CG
SCHEMBL31320207 0.85 KIF18A (0.45) KIF18AAKT1ATMPIK3CBPIK3CA
SCHEMBL22122546 0.77 GRIN2D (0.46) KIF18AATMPIK3CBPIK3CAPIK3CD
SCHEMBL22152109 0.77 GRIN2D (0.46) KIF18AATMPIK3CBPIK3CAPIK3CD
SCHEMBL22122544 0.77 GRIN2D (0.46) KIF18AATMPIK3CBPIK3CAPIK3CD
SCHEMBL30615819 0.76 RBP4 (0.46)
SCHEMBL2551286 0.75 ALDH1A1 (0.42)
SCHEMBL30615940 0.74 RBP4 (0.43) KIF18A
SCHEMBL30615956 0.74 KIF18A (0.60) KIF18A

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-4509505-A1 KIF18A INHIBITOR AND USE THEREOF Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2025-02-19 EP disclosed