SCHEMBL8776938

SCHEMBL8776938

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.51
CYP1A2 P05177 3/20 0.49
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
RECQL P46063 1/20 0.39
PDGFRB P09619 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
MAOA P21397 3/20 0.38
MAOB P27338 3/20 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
SCHEMBL8777140 0.97 CYP1A2 (0.50) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8776881 0.92 CYP1A2 (0.50) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8777303 0.91 PDE10A (0.46) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8776930 0.89 CYP1A2 (0.48) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8776915 0.89 CYP1A2 (0.42) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8777229 0.89 CYP1A2 (0.48) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8776954 0.89 CYP1A2 (0.48) PDE10ACYP1A2MAPTPOLBNPC1
SCHEMBL9607582 0.89 CYP1A2 (0.48) PDE10ACYP1A2RAB9AMAPTMEN1
SCHEMBL8777121 0.88 CYP1A2 (0.45) PDE10ACYP1A2RAB9AMAPTKDM4E
SCHEMBL8776966 0.88 PDE10A (0.46) PDE10ACYP1A2RAB9AMAPTMEN1

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 18/4885RAB9A 814/4885

“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.