SCHEMBL23958164

SCHEMBL23958164

CN(C)c1cncc(Nc2nc3ccc(F)cc3c(=O)n2C2=CC=CCC2)c1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 4/20 0.38
IDO2 Q6ZQW0 4/20 0.38
IDO1 P14902 3/20 0.38
KDM1A O60341 1/20 0.33
POLB P06746 1/20 0.31
TRPV4 Q9HBA0 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
SCHEMBL24111062 0.82 TDO2 (0.43) TDO2IDO2IDO1POLB
SCHEMBL23958151 0.80 TDO2 (0.35) TDO2IDO2IDO1POLBTRPV4
SCHEMBL24110996 0.77 PIK3CD (0.43) TDO2IDO2IDO1KDM1APOLB
SCHEMBL23958195 0.75 ABL1 (0.35) TDO2IDO2IDO1POLB
SCHEMBL23958206 0.71 ABCG2 (0.33) IDO1
SCHEMBL24111025 0.71 ABCG2 (0.43) TDO2IDO2IDO1KDM1A
SCHEMBL22237931 0.71 TDO2 (0.39) TDO2IDO2IDO1POLBTRPV4
SCHEMBL23958242 0.69 TDO2 (0.45) TDO2IDO2IDO1POLB
SCHEMBL30025705 0.69 TDO2 (0.45) TDO2IDO2IDO1POLB
SCHEMBL23958155 0.69 POLB (0.46) TDO2IDO2IDO1POLB

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-2021215537-A1 2-HETEROARYLAMINOQUINAZOLINONE DERIVATIVE 大日本住友製薬株式会社 (JP) 2021-10-28 WO disclosed