SCHEMBL8779050

SCHEMBL8779050

Cc1ccc(-c2ncc3cc(Br)ccc3n2)nc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
PDE10A Q9Y233 1/20 0.41
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
PRNP P04156 1/20 0.40
PTGFR P43088 6/20 0.39
RAB9A P51151 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PDGFRB P09619 1/20 0.37
KDR P35968 1/20 0.37
FLT3 P36888 1/20 0.37
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL3789195 0.87 KDM4E (0.47) MAPTPDE10AMAOAMAOBRAB9A
SCHEMBL8779034 0.85 KMT2A (0.44) MAPTPDE10AMAOAMAOBRAB9A
SCHEMBL8779166 0.85 PDE10A (0.41) MAPTPDE10AMAOAMAOBPTGFR
SCHEMBL8779053 0.85 PDE10A (0.41) MAPTPDE10AMAOAMAOBRAB9A
SCHEMBL8776938 0.84 PDE10A (0.51) MAPTPDE10AMAOAMAOBRAB9A
SCHEMBL8779400 0.83 NPC1 (0.50) MAOAMAOBRAB9AKDM4EMEN1
SCHEMBL8779177 0.82 MAOA (0.39) MAPTPDE10AMAOAMAOBPTGFR
SCHEMBL8777140 0.82 CYP1A2 (0.50) MAPTPDE10AMAOAMAOBRAB9A
SCHEMBL8779116 0.81 DHODH (0.40) MAPTPDE10AMAOAMAOBPTGFR
SCHEMBL8778958 0.80 CYP1A2 (0.51) MAPTRAB9AMEN1ALDH1A1POLB

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 MAPT 3067/4885PDE10A 1335/4885MAOA 737/4885

“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.