SCHEMBL8776032

SCHEMBL8776032

Oc1cc(F)ccc1-c1cccc(-c2ncc3ccccc3n2)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.40
CYP1A2 P05177 3/20 0.40
MAPT P10636 4/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MAPK1 P28482 1/20 0.36
GRM5 P41594 1/20 0.35
NPC1 O15118 4/20 0.35
RAB9A P51151 2/20 0.35
CASP6 P55212 3/20 0.34
AR P10275 1/20 0.33

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
SCHEMBL8776103 0.91 NPC1 (0.40) CHEK2CYP1A2MAPTMEN1ALDH1A1
SCHEMBL8775365 0.88 L3MBTL1 (0.43) CYP1A2MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL3794048 0.86 AR (0.39) CYP1A2MAPTMEN1ALDH1A1KMT2A
SCHEMBL8776037 0.85 L3MBTL1 (0.43) CYP1A2ALDH1A1L3MBTL1CASP3SENP8
SCHEMBL8776258 0.85 CYP1A2 (0.39) CYP1A2L3MBTL1CASP3SENP8SENP7
SCHEMBL8775741 0.85 CYP1A2 (0.44) CYP1A2MAPTMEN1ALDH1A1KMT2A
SCHEMBL8775608 0.83 ABL1 (0.40) CYP1A2AR
SCHEMBL8776017 0.83 KCNH2 (0.45) MEN1ALDH1A1KMT2AL3MBTL1GRM5
SCHEMBL8777064 0.82 MBNL1 (0.39) CHEK2CYP1A2MAPTMEN1ALDH1A1
SCHEMBL8775539 0.80 L3MBTL1 (0.47) CYP1A2MEN1ALDH1A1KMT2AL3MBTL1

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 CHEK2 2982/4885CYP1A2 18/4885MAPT 3067/4885

“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.