SCHEMBL8776954

SCHEMBL8776954

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.48
PDE10A Q9Y233 4/20 0.40
MAPK14 Q16539 4/20 0.39
MAPK10 P53779 2/20 0.39
KDM1A O60341 1/20 0.38
ADORA2A P29274 1/20 0.37
NPC1 O15118 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.35
ADORA1 P30542 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
STAT3 P40763 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDK1 Q15118 1/20 0.35

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
SCHEMBL8776881 0.89 CYP1A2 (0.50) CYP1A2PDE10AADORA2ANPC1ABCG2
SCHEMBL8777140 0.89 CYP1A2 (0.50) CYP1A2PDE10ANPC1LMNAPOLB
SCHEMBL8776938 0.89 PDE10A (0.51) CYP1A2PDE10ANPC1LMNAPOLB
SCHEMBL3793053 0.88 CYP1A2 (0.44) CYP1A2PDE10ANPC1
SCHEMBL8777022 0.87 CYP1A2 (0.46) CYP1A2PDE10ANPC1MAPTSMN1; SMN2
SCHEMBL8776930 0.87 CYP1A2 (0.48) CYP1A2PDE10AADORA2ANPC1ADORA1
SCHEMBL8777229 0.87 CYP1A2 (0.48) CYP1A2PDE10AMAPK10KDM1AADORA2A
SCHEMBL9607582 0.87 CYP1A2 (0.48) CYP1A2PDE10AMAPK14KDM1ANPC1
SCHEMBL30129477 0.86 CYP1A2 (0.45) CYP1A2PDE10ANPC1PDK1
SCHEMBL8776961 0.86 CYP1A2 (0.45) CYP1A2PDE10AKDM1AABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CYP1A2 18/4885PDE10A 1335/4885MAPK14 386/4885

“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.