SCHEMBL8776597

SCHEMBL8776597

Cc1ccc(-c2nc(-c3ncc4ccccc4n3)ccc2C)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.39
MAPT P10636 5/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK10 P53779 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
MBNL1 Q9NR56 1/20 0.36
AR P10275 1/20 0.36
SMN1; SMN2 Q16637 5/20 0.35
RAB9A P51151 5/20 0.35
KDM4E B2RXH2 2/20 0.35
POLB P06746 2/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NQO2 P16083 1/20 0.34

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
SCHEMBL8776451 0.91 CYP1A2 (0.40) CYP1A2MAPTALDH1A1MEN1KMT2A
SCHEMBL8776700 0.88 CRHR1 (0.41) CYP1A2MAPTALDH1A1MEN1ALOX12
SCHEMBL8776542 0.88 MBNL1 (0.40) CYP1A2MAPTALDH1A1MEN1ALOX12
SCHEMBL8776882 0.87 CYP1A2 (0.40) CYP1A2MAPTALDH1A1MEN1ALOX12
SCHEMBL3789674 0.87 PDE10A (0.44) CYP1A2MAPTALDH1A1MEN1KMT2A
SCHEMBL3794038 0.86 MBNL1 (0.45) CYP1A2MBNL1ARNQO2NPC1
SCHEMBL3791644 0.85 CRHR1 (0.43) CYP1A2MAPTALDH1A1MEN1KMT2A
SCHEMBL8776714 0.84 KMT2A (0.39) CYP1A2MAPTALDH1A1MEN1KMT2A
SCHEMBL8776023 0.84 MAPT (0.41) CYP1A2MAPTALDH1A1MEN1ALOX12
SCHEMBL8777141 0.84 CYP1A2 (0.47) CYP1A2MAPTALDH1A1MEN1ALOX12

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 18/4885MAPT 3067/4885ALDH1A1 1125/4885

“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.