SCHEMBL534615

SCHEMBL534615

C#Cc1cnc2ccc(OC(SC)C(=O)NC3(C(N)=O)CCC3)cc2c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.32
AURKA O14965 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
IGF1R P08069 1/20 0.31
MET P08581 1/20 0.31
KIT P10721 1/20 0.31
FGFR2 P21802 1/20 0.31
EPHA2 P29317 1/20 0.31
LTK P29376 1/20 0.31
AXL P30530 1/20 0.31
FLT3 P36888 1/20 0.31
MST1R Q04912 1/20 0.31
ALDH1A1 P00352 1/20 0.31
F2 P00734 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
PTGFR P43088 1/20 0.31
FPR2 P25090 1/20 0.31
SCN9A Q15858 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
SCHEMBL534714 0.90 ALDH1A1 (0.32) ALDH1A1F2GLAHPGDPTGFR
SCHEMBL3805501 0.88 GPR88 (0.34) ALDH1A1F2GLAHPGDPTGFR
SCHEMBL2866336 0.87 ALDH1A1 (0.32) ALDH1A1F2GLAHPGDPTGFR
SCHEMBL534833 0.86 ALDH1A1 (0.31) METALDH1A1F2GLAHPGD
SCHEMBL534679 0.86 SCN9A (0.36) METALDH1A1F2GLAHPGD
SCHEMBL3724346 0.86 KDM4E (0.38) ALDH1A1F2GLAHPGDABL1
SCHEMBL2869255 0.85 ALDH1A1 (0.33) ALDH1A1F2GLAHPGDPTGFR
SCHEMBL3737469 0.85 KDM4E (0.33) ALDH1A1F2GLAHPGDPTGFR
SCHEMBL534616 0.83 PTGFR (0.30) ALDH1A1F2GLAHPGDPTGFR
SCHEMBL534715 0.82 ALDH1A1 (0.31) ALDH1A1F2GLAHPGD

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
US-8507509-B2 Saturated and insaturated bi- or tricyclic aryloxyacetamine derivatives and their use as fungicides SYNGENTA CROP PROTECTION LLC (US) 2013-08-13 US disclosed
EP-2185518-B1 Aryloxyacetamide derivatives and their use as fungicides SYNGENTA PARTICIPATIONS AG (CH) 2012-02-08 EP disclosed
US-20100298356-A1 SATURATED AND INSATURATED BI- OR TRICYCLIC ARYLOXYACETAMINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-25 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-20100298356-A1 SATURATED AND INSATURATED BI- OR TRICYCLIC ARYLOXYACETAMINE DERIVATIVES AND THEIR USE AS FUNGICIDES CYP1A2, CYP1B1, CYP1A1 PARP1 4723/4885AURKA 3222/4885LCK 2855/4885

“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.