SCHEMBL8776679

SCHEMBL8776679

Cc1ccc(-c2ncc3ccccc3n2)nc1-c1cccc(Cl)c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MBNL1 Q9NR56 1/20 0.39
AR P10275 2/20 0.36
CYP1A2 P05177 6/20 0.36
KMO O15229 2/20 0.34
ELANE P08246 2/20 0.34
PDE10A Q9Y233 2/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
NPC1 O15118 1/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
MAPK1 P28482 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
SCHEMBL8776689 0.89 ALDH1A1 (0.43) MBNL1CYP1A2ELANEPDE10AALDH1A1
SCHEMBL8776661 0.88 MBNL1 (0.46) MBNL1ARCYP1A2PDE10AL3MBTL1
SCHEMBL8776621 0.88 CYP1A2 (0.37) MBNL1ARCYP1A2ELANEPDE10A
SCHEMBL8777333 0.87 AR (0.36) MBNL1ARCYP1A2
SCHEMBL8776753 0.84 MAOA (0.43) MBNL1ARCYP1A2ALDH1A1KDM4E
SCHEMBL8776992 0.84 MBNL1 (0.56) MBNL1ARCYP1A2PDE10AALDH1A1
SCHEMBL8776665 0.83 MBNL1 (0.40) MBNL1ARCYP1A2PDE10AALDH1A1
SCHEMBL8776867 0.83 MBNL1 (0.38) MBNL1ARCYP1A2NPC1GAA
SCHEMBL8776076 0.83 KMO (0.44) ARCYP1A2KMOELANEPDE10A
SCHEMBL3789674 0.82 PDE10A (0.44) MBNL1ARCYP1A2PDE10AALDH1A1

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 3869/4885CYP1A2 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.