SCHEMBL8777811

SCHEMBL8777811

FC(F)(F)c1ccc(Cc2cccc(-c3ncc4ccccc4n3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP1 O94782 7/20 0.44
WDR48 Q8TAF3 7/20 0.44
KCNA5 P22460 1/20 0.38
APP P05067 2/20 0.37
TRPV3 Q8NET8 3/20 0.36
CYP1A2 P05177 2/20 0.35
LTA4H P09960 1/20 0.34
GRM5 P41594 1/20 0.34

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
SCHEMBL8777792 0.88 APP (0.41) USP1WDR48APPCYP1A2LTA4H
SCHEMBL8777791 0.88 SMN1; SMN2 (0.39) USP1WDR48CYP1A2
SCHEMBL8777762 0.86 USP1 (0.39) USP1WDR48KCNA5CYP1A2
SCHEMBL3787262 0.86 CYP1A2 (0.40) USP1WDR48CYP1A2
SCHEMBL29368748 0.86 CYP1A2 (0.40) USP1WDR48CYP1A2
SCHEMBL8777888 0.84 SMN1; SMN2 (0.40) APPCYP1A2
SCHEMBL9607508 0.84 L3MBTL1 (0.46) APPCYP1A2
SCHEMBL8778144 0.84 USP1 (0.39) USP1WDR48CYP1A2
SCHEMBL8865272 0.83 USP1 (0.39) USP1WDR48TRPV3
SCHEMBL8775705 0.81 CYP1A2 (0.43) USP1WDR48KCNA5TRPV3CYP1A2

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 USP1 2963/4885WDR48 4477/4885KCNA5 1001/4885

“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.