SCHEMBL8779392

SCHEMBL8779392

Cc1nc(-c2cccc(Cc3ccccc3)n2)nc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.46
ALDH1A1 P00352 4/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.41
NUDT1 P36639 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GPR3 P46089 1/20 0.41
BRD4 O60885 1/20 0.40
TGFBR1 P36897 3/20 0.40
MAPK14 Q16539 1/20 0.40
KMT2A Q03164 6/20 0.39
MEN1 O00255 4/20 0.39
NPC1 O15118 2/20 0.39
PDE5A O76074 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
JAK2 O60674 1/20 0.38
METAP1 P53582 1/20 0.38
PPP1CA P62136 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL8779715 0.91 MAPT (0.44) PDE10AALDH1A1HPGDCYP1A2NUDT1
SCHEMBL14733012 0.84 PDE10A (0.47) PDE10AALDH1A1HPGDCYP1A2NUDT1
SCHEMBL8779457 0.83 SMN1; SMN2 (0.41) ALDH1A1CYP1A2BRD4TGFBR1MAPK14
SCHEMBL9607741 0.83 BRD4 (0.40) ALDH1A1BRD4KMT2AMEN1NPC1
SCHEMBL3787489 0.82 MAPT (0.50) ALDH1A1HPGDCYP1A2KMT2AMEN1
SCHEMBL8779492 0.81 KDM4E (0.41) ALDH1A1HPGDCYP1A2BRD4KMT2A
SCHEMBL8779730 0.81 PDE10A (0.40) PDE10AALDH1A1HPGDCYP1A2NUDT1
SCHEMBL8779470 0.81 BRD4 (0.39) ALDH1A1BRD4TGFBR1KMT2AMEN1
SCHEMBL9027654 0.80 BRD4 (0.45) ALDH1A1BRD4KMT2AMEN1NPC1
SCHEMBL8779415 0.80 MAPT (0.53) ALDH1A1CYP1A2BRD4KMT2AMEN1

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 3 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
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 PDE10A 1335/4885ALDH1A1 1125/4885HPGD 1679/4885

“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.