SCHEMBL22337069

SCHEMBL22337069

Cn1ncc2cc(C#N)nnc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.33
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.31
KDM1A O60341 1/20 0.30
APP P05067 1/20 0.30
NOTUM Q6P988 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
SCHEMBL22336157 0.73 APP (0.33) APPNOTUM
SCHEMBL22337158 0.72 APP (0.32) APPNOTUM
SCHEMBL29268144 0.72 PDE2A (0.39) TP53MAPTAPPNOTUM
SCHEMBL16887703 0.71 TP53 (0.43) CYP11B2TP53
SCHEMBL23357368 0.70 ALDH1A1 (0.41) TP53MAPT
SCHEMBL30711996 0.70 ALDH1A1 (0.41) TP53MAPT
SCHEMBL30971302 0.70 CYP11B2 (0.32) CYP11B2TP53MAPTKDM1A
SCHEMBL30711998 0.70 MAPT (0.36) CYP11B2TP53MAPTKDM1A
SCHEMBL23357465 0.70 MAPT (0.36) CYP11B2TP53MAPTKDM1A
SCHEMBL31194514 0.69 CTSS (0.40) TP53

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-2020161209-A1 HERBICIDAL FUSED PYRIDAZINE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 WO disclosed