SCHEMBL8776037

SCHEMBL8776037

Fc1ccc(F)c(-c2cccc(-c3ncc4ccccc4n3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
NPC1 O15118 3/20 0.42
CYP1A2 P05177 3/20 0.40
TGFBR1 P36897 1/20 0.39
GRM5 P41594 1/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CTSA P10619 1/20 0.35

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
SCHEMBL8775365 0.89 L3MBTL1 (0.43) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL8775888 0.88 NPC1 (0.41) NPC1CYP1A2TGFBR1AR
SCHEMBL8776103 0.87 NPC1 (0.40) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL8775608 0.87 ABL1 (0.40) CYP1A2CTSAMBNL1AR
SCHEMBL8775804 0.87 NPC1 (0.40) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL8776101 0.87 NPC1 (0.40) NPC1CYP1A2TGFBR1CTSAMBNL1
SCHEMBL8775844 0.86 CYP1A2 (0.43) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL8775659 0.86 NPC1 (0.52) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL8776032 0.85 CHEK2 (0.40) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL8775832 0.85 CYP1A2 (0.40) L3MBTL1CASP3SENP8SENP7SENP6

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 L3MBTL1 3069/4885CASP3 540/4885SENP8 4124/4885

“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.