SCHEMBL8776935

SCHEMBL8776935

CNC(=O)c1cccc(-c2nc(-c3ncc4ccccc4n3)ccc2C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.46
PDE2A O00408 1/20 0.46
MAP4K4 O95819 2/20 0.46
CDK8 P49336 1/20 0.44
BAZ2B Q9UIF8 1/20 0.43
FYN P06241 4/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.42
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
LRRK2 Q5S007 1/20 0.40
CSNK1G2 P78368 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
MAP4K5 Q9Y4K4 1/20 0.40
CSNK1D P48730 1/20 0.39
PLK1 P53350 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL8777300 0.88 MAP4K4 (0.53) PDE10AMAP4K4CDK8FYNKMT2A
SCHEMBL8777284 0.87 PDE10A (0.46) PDE10AMAP4K4CDK8MAPTKDM5B
SCHEMBL8863633 0.87 MAP4K4 (0.51) PDE10APDE2AMAP4K4CDK8BAZ2B
SCHEMBL8776852 0.82 CYP1A2 (0.42) PDE10AKMT2AMEN1MAPTCYP1A2
SCHEMBL8776966 0.82 PDE10A (0.46) PDE10AKMT2AMEN1MAPTCYP1A2
SCHEMBL8777303 0.82 PDE10A (0.46) PDE10AMAP4K4KMT2AMEN1MAPT
SCHEMBL8776938 0.80 PDE10A (0.51) PDE10AKMT2AMEN1MAPTCYP1A2
SCHEMBL8777323 0.80 NPC1 (0.46) PDE10AMAP4K4KMT2AMEN1MAPT
SCHEMBL8776955 0.80 CYP1A2 (0.42) PDE10AMAP4K4CLK4CYP1A2
SCHEMBL8777123 0.80 PDE10A (0.44) PDE10ACYP1A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012069652-A2 FUNGICIDE MIXTURES SYNGENTA PARTICIPATIONS AG (CH) 2012-05-31 WO disclosed
US-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-05-24 US disclosed
US-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-05-24 US disclosed
WO-2010136475-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-12-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120129875-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES NAT1, NQO2, NOX1 PDE10A 1335/4885PDE2A 416/4885MAP4K4 1264/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.