SCHEMBL8776676

SCHEMBL8776676

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1cc(F)c(F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MBNL1 Q9NR56 1/20 0.44
CYP1A2 P05177 4/20 0.38
NPC1 O15118 3/20 0.36
AR P10275 5/20 0.36
PDE10A Q9Y233 2/20 0.33
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
ALOX12 P18054 1/20 0.31
MAPK10 P53779 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL3794038 0.88 MBNL1 (0.45) MBNL1CYP1A2NPC1AR
SCHEMBL8776465 0.88 MBNL1 (0.45) MBNL1CYP1A2NPC1ARPDE10A
SCHEMBL8777019 0.88 MBNL1 (0.45) MBNL1CYP1A2NPC1ARALDH1A1
SCHEMBL8777316 0.87 MBNL1 (0.40) MBNL1CYP1A2NPC1ARMEN1
SCHEMBL8776992 0.87 MBNL1 (0.56) MBNL1CYP1A2NPC1ARPDE10A
SCHEMBL8776807 0.87 MBNL1 (0.44) MBNL1CYP1A2NPC1AR
SCHEMBL8776622 0.86 MBNL1 (0.43) MBNL1CYP1A2NPC1ARTDP1
SCHEMBL8776610 0.85 MBNL1 (0.41) MBNL1CYP1A2ARPDE10A
SCHEMBL8776777 0.84 MBNL1 (0.41) MBNL1CYP1A2NPC1AR
SCHEMBL8776665 0.84 MBNL1 (0.40) MBNL1CYP1A2NPC1ARPDE10A

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 MBNL1 4381/4885CYP1A2 18/4885NPC1 346/4885

“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.