SCHEMBL8779746

SCHEMBL8779746

Cc1ccc(-c2nc(C)c3ccccc3n2)nc1-c1cc(F)cc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.45
ABCG2 Q9UNQ0 6/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
HPGD P15428 1/20 0.38
NUDT1 P36639 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 3/20 0.38
GPR3 P46089 1/20 0.37
KDM1A O60341 1/20 0.37
ADORA2A P29274 1/20 0.36
ABCB1 P08183 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
PDE5A O76074 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
SCHEMBL3787452 0.86 PDE10A (0.54) PDE10AABCG2POLBALDH1A1CYP1A2
SCHEMBL8779590 0.85 MAPT (0.51) ABCG2POLBALDH1A1CYP1A2HPGD
SCHEMBL8779739 0.80 ABCG2 (0.49) PDE10AABCG2ALDH1A1HPGDMAPT
SCHEMBL3793053 0.80 CYP1A2 (0.44) PDE10AALDH1A1CYP1A2
SCHEMBL28054446 0.76 ABCG2 (0.57) PDE10AABCG2POLBALDH1A1CYP1A2
SCHEMBL8818429 0.75 TGFBR1 (0.51) ABCG2ADORA2A
SCHEMBL12318278 0.74 DHODH (0.45) PDE10APOLBCYP1A2HSD17B10SMN1; SMN2
SCHEMBL16070244 0.74 ABCG2 (0.58) PDE10AABCG2ALDH1A1CYP1A2HPGD
SCHEMBL8779307 0.72 KDM4E (0.49) ALDH1A1CYP1A2HPGDHSD17B10MAPT
SCHEMBL8779217 0.72 PARP1 (0.42) PDE10APOLBALDH1A1HPGDHSD17B10

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 1335/4885ABCG2 603/4885POLB 4191/4885

“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.