SCHEMBL8775432

SCHEMBL8775432

COc1ccc(-c2cccc(-c3ncc4ccccc4n3)n2)c(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 4/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 5/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
MAPT P10636 3/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
ATM Q13315 1/20 0.44
TLR9 Q9NR96 1/20 0.44
CYP1A1 P04798 2/20 0.44
CYP1B1 Q16678 2/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2E1 P05181 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C8 P10632 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL8775546 0.90 L3MBTL1 (0.47) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL8775971 0.88 NPC1 (0.41) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL17653985 0.87 MEN1 (0.48) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL30900832 0.87 MEN1 (0.48) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL8776017 0.87 KCNH2 (0.45) MEN1KMT2ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL8775564 0.87 NPC1 (0.49) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL8775247 0.86 ALDH1A1 (0.46) MEN1KMT2AKDM4ESMN1; SMN2NPC1
SCHEMBL8776097 0.84 NPC1 (0.49) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL8776507 0.84 CRHR1 (0.43) MEN1KMT2AKDM4EPOLBSMN1; SMN2
SCHEMBL8776285 0.83 MEN1 (0.40) MEN1KMT2AKDM4EPOLBSMN1; SMN2

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 MEN1 571/4885KMT2A 2145/4885KDM4E 1794/4885

“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.