SCHEMBL23355478

SCHEMBL23355478

NC(=O)Oc1ccc(Oc2nc(-c3nnc(C4CC4)o3)cs2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
ATR Q13535 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
BACE1 P56817 1/20 0.32
BACE2 Q9Y5Z0 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
SMO Q99835 1/20 0.30
SCN9A Q15858 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
SCHEMBL21612850 0.86 MAPT (0.33) MAPTATRGPR119BACE1BACE2
SCHEMBL24926748 0.84 BACE1 (0.36) MAPTATRGPR119BACE1BACE2
SCHEMBL23355350 0.82 MAPK14 (0.35) MAPTSMO
SCHEMBL21612849 0.81 MAPT (0.33) MAPTATRBACE1BACE2
SCHEMBL28537439 0.81 ATR (0.32) ATRBACE1BACE2CA1CA2
SCHEMBL24926751 0.78 BRAF (0.40) MAPTSMO
SCHEMBL23355446 0.72 SCN9A (0.36) SCN9A
SCHEMBL23355355 0.72 LRRK2 (0.32)
SCHEMBL23355323 0.72 MEN1 (0.40)
SCHEMBL28523464 0.72 MEN1 (0.38)

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-3822263-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2021-05-19 EP disclosed
CN-112334460-A Biaryl ether type quinazoline derivative 第一三共株式会社 2021-02-05 CN disclosed