SCHEMBL535446

SCHEMBL535446

CO/N=C/C(C)(C)NC(=O)C(Oc1ccc2ncc(Br)cc2c1)SC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
F2 P00734 1/20 0.34
GLA P06280 1/20 0.34
MET P08581 5/20 0.34
KDM4E B2RXH2 3/20 0.33
KDR P35968 2/20 0.32
AURKA O14965 1/20 0.32
ABL1 P00519 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
YES1 P07947 1/20 0.32
FGFR2 P21802 1/20 0.32
EPHA2 P29317 1/20 0.32
LTK P29376 1/20 0.32
AXL P30530 1/20 0.32
FLT3 P36888 1/20 0.32
MST1R Q04912 1/20 0.32
PTK6 Q13882 1/20 0.32
ALPL P05186 1/20 0.32

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
SCHEMBL535447 1.00 ALDH1A1 (0.34) ALDH1A1HPGDF2GLAMET
SCHEMBL534510 0.92 MET (0.34) ALDH1A1HPGDF2GLAMET
SCHEMBL534509 0.92 MET (0.34) ALDH1A1HPGDF2GLAMET
SCHEMBL534820 0.91 MET (0.35) ALDH1A1HPGDF2GLAMET
SCHEMBL534819 0.91 MET (0.35) ALDH1A1HPGDF2GLAMET
SCHEMBL12181871 0.91 HPGD (0.42) ALDH1A1HPGDF2GLAMET
SCHEMBL14763523 0.91 HPGD (0.42) ALDH1A1HPGDF2GLAMET
SCHEMBL535329 0.91 ALDH1A1 (0.33) ALDH1A1HPGDF2GLAMET
SCHEMBL535328 0.91 ALDH1A1 (0.33) ALDH1A1HPGDF2GLAMET
SCHEMBL534854 0.90 MET (0.33) ALDH1A1HPGDF2GLAMET

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 5 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
EP-2185518-A2 SATURATED AND INSATURATED BI- OR TRICYCLIC ARYLOXYACETAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES Syngenta Participations AG (CH) 2010-05-19 EP disclosed
WO-2009030467-A2 SATURATED AND INSATURATED BI- OR TRICYCLIC ARYLOXYACETAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG, (CH) 2009-03-12 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-20100298356-A1 SATURATED AND INSATURATED BI- OR TRICYCLIC ARYLOXYACETAMINE DERIVATIVES AND THEIR USE AS FUNGICIDES CYP1A2, CYP1B1, CYP1A1 ALDH1A1 109/4885HPGD 2661/4885F2 3671/4885

“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.