SCHEMBL8779730

SCHEMBL8779730

Cc1cccc(Cc2cccc(-c3nc(C)c4ccccc4n3)n2)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.40
CYP1A2 P05177 4/20 0.35
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
NUDT1 P36639 1/20 0.35
CYP2D6 P10635 3/20 0.35
CLK4 Q9HAZ1 3/20 0.35
CYP2C19 P33261 2/20 0.35
CYP3A4 P08684 2/20 0.35
USP2 O75604 1/20 0.35
ALOX15 P16050 1/20 0.35
TGFBR1 P36897 6/20 0.35
MAPK14 Q16539 1/20 0.35
GPR3 P46089 1/20 0.35
MPO P05164 1/20 0.34
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL8779524 0.86 NR1I3 (0.43) CYP1A2ALDH1A1HPGDCYP2C19CYP3A4
SCHEMBL3789630 0.81 CYP1A2 (0.36) PDE10ACYP1A2MPOMEN1KMT2A
SCHEMBL8779392 0.81 PDE10A (0.46) PDE10ACYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL8779715 0.78 MAPT (0.44) PDE10ACYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL14733012 0.77 PDE10A (0.47) PDE10ACYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL14732922 0.72 TGFBR1 (0.47) PDE10ACYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL8884919 0.70 PDE10A (0.62) PDE10ACYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL3787877 0.70 CYP1A2 (0.39) CYP1A2MEN1RAB9AKMT2A
SCHEMBL8779779 0.69 PDE10A (0.43) PDE10ACYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL8872433 0.68 PDE10A (0.49) PDE10ACYP1A2ALDH1A1HSD17B10HPGD

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
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
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 18/4885ALDH1A1 1125/4885

“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.