SCHEMBL8778192

SCHEMBL8778192

Cc1ccc(C)c(Cc2cccc(-c3ncc4ccccc4n3)n2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.36
TSHR P16473 2/20 0.36
TNF P01375 1/20 0.36
TP53 P04637 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
GAA P10253 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
PDE10A Q9Y233 1/20 0.32
NQO2 P16083 1/20 0.32
NPC1 O15118 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
SCHEMBL8778312 0.91 TNF (0.38) CYP1A2TNFMEN1KMT2AMAPT
SCHEMBL3787877 0.88 CYP1A2 (0.39) CYP1A2MEN1KMT2ALMNAL3MBTL1
SCHEMBL8778433 0.84 CYP1A2 (0.36) CYP1A2TSHRTNFTP53MEN1
SCHEMBL8778044 0.83 CYP2C19 (0.38) CYP1A2TSHRTP53MEN1KMT2A
SCHEMBL8778305 0.83 CYP1A2 (0.37) CYP1A2TP53MEN1KMT2AMAPT
SCHEMBL8777888 0.83 SMN1; SMN2 (0.40) CYP1A2TSHRTP53MEN1KMT2A
SCHEMBL3789630 0.81 CYP1A2 (0.36) CYP1A2MEN1KMT2ALMNAL3MBTL1
SCHEMBL8778292 0.79 CYP1A2 (0.34) CYP1A2TSHRTP53MEN1KMT2A
SCHEMBL3786375 0.79 CYP1A2 (0.40) CYP1A2MEN1KMT2AMAPTNPSR1
SCHEMBL3787482 0.78 NPSR1 (0.39) TP53MEN1KMT2AMAPTL3MBTL1

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 CYP1A2 18/4885TSHR 4374/4885TNF 3852/4885

“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.