SCHEMBL8776966

SCHEMBL8776966

Cc1cccc(-c2nc(-c3ncc4ccccc4n3)ccc2C)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.46
CYP1A2 P05177 2/20 0.44
NR1I3 Q14994 1/20 0.43
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
DPP4 P27487 1/20 0.40
RAB9A P51151 1/20 0.39
ABCB1 P08183 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
ATR Q13535 1/20 0.39
ADORA1 P30542 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
RAD52 P43351 1/20 0.38

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
SCHEMBL8777303 0.90 PDE10A (0.46) PDE10ACYP1A2NR1I3RAB9AMAPT
SCHEMBL3788033 0.90 CYP1A2 (0.46) PDE10ACYP1A2NR1I3ADORA1
SCHEMBL8776938 0.88 PDE10A (0.51) PDE10ACYP1A2RAB9AMAPTSMN1; SMN2
SCHEMBL8777123 0.88 PDE10A (0.44) PDE10ACYP1A2NR1I3DPP4ABCG2
SCHEMBL8776852 0.88 CYP1A2 (0.42) PDE10ACYP1A2RAB9AMAPTSMN1; SMN2
SCHEMBL8776955 0.88 CYP1A2 (0.42) PDE10ACYP1A2BCHEACHEDPP4
SCHEMBL8777323 0.88 NPC1 (0.46) PDE10ACYP1A2RAB9AMAPTSMN1; SMN2
SCHEMBL8776481 0.87 NPC1 (0.50) PDE10ACYP1A2RAB9AMAPTSMN1; SMN2
SCHEMBL8777080 0.86 CYP1A2 (0.48) PDE10ACYP1A2RAB9ASMN1; SMN2ADORA1
SCHEMBL8777237 0.85 PDE10A (0.41) PDE10ACYP1A2NR1I3ABCB1ABCG2

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 1335/4885CYP1A2 18/4885NR1I3 1258/4885

“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.