SCHEMBL8776737

SCHEMBL8776737

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1cc(Cl)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.37
PDE2A O00408 1/20 0.37
CYP1A2 P05177 3/20 0.36
IDO1 P14902 2/20 0.34
HTR2B P41595 1/20 0.34
PDE4D Q08499 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
MBNL1 Q9NR56 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
S1PR4 O95977 1/20 0.33
AR P10275 1/20 0.33
ALPL P05186 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
JAK2 O60674 1/20 0.32
CRHR1 P34998 1/20 0.32

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
SCHEMBL8776925 0.93 CYP1A2 (0.38) PDE10ACYP1A2IDO1KDM4EALDH1A1
SCHEMBL8776589 0.91 CRHR1 (0.41) CYP1A2KDM4ELMNAMAPTCRHR1
SCHEMBL8776807 0.89 MBNL1 (0.44) CYP1A2PDE4DMBNL1ARALPL
SCHEMBL8776700 0.89 CRHR1 (0.41) PDE10ACYP1A2KDM4EALDH1A1MBNL1
SCHEMBL8776689 0.88 ALDH1A1 (0.43) PDE10ACYP1A2KDM4EALDH1A1GLA
SCHEMBL8777029 0.86 L3MBTL1 (0.43) KDM4EALDH1A1L3MBTL1ALPLLMNA
SCHEMBL8776867 0.84 MBNL1 (0.38) CYP1A2MBNL1ARMAPTHTT
SCHEMBL8777294 0.83 HSD11B1 (0.37) CYP1A2KDM4EMBNL1
SCHEMBL8776930 0.83 CYP1A2 (0.48) PDE10ACYP1A2KDM4EALDH1A1L3MBTL1
SCHEMBL8776635 0.82 CYP1A2 (0.45) PDE10ACYP1A2KDM4EALDH1A1LMNA

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 416/4885CYP1A2 18/4885

“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.