SCHEMBL1609822

SCHEMBL1609822

COC(=O)c1nc(C2CC2)nc(NCc2cccc(C(F)(F)F)c2)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.45
KMT2A Q03164 2/20 0.43
ACACB O00763 1/20 0.43
MEN1 O00255 1/20 0.43
PLA2G1B P04054 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
GAA P10253 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
RPS6KB1 P23443 3/20 0.43
AURKA O14965 2/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL1609481 0.90 PDE10A (0.41) PDE10ACYP3A4CYP2D6RPS6KB1AURKA
SCHEMBL1609710 0.88 PDE10A (0.47) PDE10ARPS6KB1AURKACNR1
SCHEMBL1610245 0.87 PDE10A (0.47) PDE10ARPS6KB1AURKA
SCHEMBL12712720 0.87 PDE10A (0.49) PDE10AHTT
SCHEMBL1608975 0.87 PDE10A (0.39) PDE10ACYP3A4HTT
SCHEMBL1609721 0.86 PDE10A (0.51) PDE10ARPS6KB1AURKAAPP
SCHEMBL1608948 0.86 KMT2A (0.37) KMT2AMEN1KDM4EPOLB
SCHEMBL1609641 0.85 PDE10A (0.47) PDE10ARPS6KB1AURKAAPP
SCHEMBL1610080 0.85 PDE10A (0.47) PDE10A
SCHEMBL1609704 0.85 PDE10A (0.62) PDE10ACYP1A2CYP3A4GAACYP2C19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 PDE10A 1704/4885KMT2A 2003/4885ACACB 2387/4885

“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.