SCHEMBL1610985

SCHEMBL1610985

COC(=O)c1nc(C2CC2)nc(N(C)c2ccc(Cl)cc2F)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 3/20 0.36
KMT2A Q03164 2/20 0.33
STAT3 P40763 1/20 0.33
ALDH1A1 P00352 3/20 0.33
S1PR4 O95977 1/20 0.33
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 1/20 0.32
PROKR1 Q8TCW9 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 1/20 0.31
POLB P06746 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
ABL1 P00519 1/20 0.31
GPR6 P46095 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL1609254 0.92 NTSR1 (0.34) SLC6A3ALDH1A1
SCHEMBL1609112 0.90 SLC6A3 (0.42) SLC6A3KMT2ASTAT3ALDH1A1S1PR4
SCHEMBL1609825 0.89 PDE10A (0.31) SLC6A3ALDH1A1
SCHEMBL1610295 0.88 PSEN1 (0.36) SLC6A3KMT2AALDH1A1MEN1
SCHEMBL1610229 0.84 SLC6A3 (0.34) SLC6A3ALDH1A1PDE4APDE4BPDE4C
SCHEMBL1610512 0.83 SLC6A3 (0.33) SLC6A3KMT2AALDH1A1PDE4DKDM4E
SCHEMBL1609145 0.83 TUBB4A (0.43) SLC6A3ALDH1A1PDE4BPDE4DKDM4E
SCHEMBL1608874 0.81 SLC6A3 (0.39) SLC6A3KMT2ASTAT3ALDH1A1PDE4A
SCHEMBL1609765 0.81 HTT (0.41) KMT2AALDH1A1SMN1; SMN2L3MBTL1MEN1
SCHEMBL1609761 0.80 RXRA (0.36) SLC6A3KMT2AALDH1A1PDE4APDE4B

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 1 patent. 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

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 SLC6A3 2437/4885KMT2A 2003/4885STAT3 3880/4885

“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.