SCHEMBL8776777

SCHEMBL8776777

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1cc(F)cc(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MBNL1 Q9NR56 1/20 0.41
AR P10275 6/20 0.37
FFAR1 O14842 1/20 0.36
CYP1A2 P05177 3/20 0.36
NPC1 O15118 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
MET P08581 1/20 0.32
ABL1 P00519 1/20 0.31

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
SCHEMBL8777019 0.87 MBNL1 (0.45) MBNL1ARCYP1A2NPC1L3MBTL1
SCHEMBL8776465 0.87 MBNL1 (0.45) MBNL1ARCYP1A2NPC1L3MBTL1
SCHEMBL8776610 0.87 MBNL1 (0.41) MBNL1ARCYP1A2L3MBTL1CASP3
SCHEMBL8776661 0.86 MBNL1 (0.46) MBNL1ARCYP1A2NPC1L3MBTL1
SCHEMBL8776676 0.84 MBNL1 (0.44) MBNL1ARCYP1A2NPC1
SCHEMBL8776859 0.84 CYP1A2 (0.43) MBNL1ARCYP1A2NPC1
SCHEMBL8776992 0.84 MBNL1 (0.56) MBNL1ARCYP1A2NPC1L3MBTL1
SCHEMBL8776542 0.83 MBNL1 (0.40) MBNL1ARCYP1A2NPC1L3MBTL1
SCHEMBL8776665 0.83 MBNL1 (0.40) MBNL1ARCYP1A2NPC1
SCHEMBL3793053 0.83 CYP1A2 (0.44) MBNL1ARCYP1A2NPC1MET

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 4381/4885AR 3869/4885FFAR1 2371/4885

“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.