SCHEMBL534754

SCHEMBL534754

C#Cc1cnc2ccc(OC(SC)C(=O)NC(C)(C)C/C=N/OC)cc2c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 2/20 0.32
ALDH1A1 P00352 3/20 0.31
HPGD P15428 3/20 0.31
F2 P00734 1/20 0.31
GLA P06280 1/20 0.31
KDM4E B2RXH2 3/20 0.30
LMNA P02545 1/20 0.30
THRB P10828 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL534755 1.00 MET (0.32) METALDH1A1HPGDF2GLA
SCHEMBL533634 0.87 ALDH1A1 (0.32) METALDH1A1HPGDF2GLA
SCHEMBL533635 0.87 ALDH1A1 (0.32) METALDH1A1HPGDF2GLA
SCHEMBL534780 0.87 MET (0.33) METALDH1A1HPGDF2GLA
SCHEMBL534779 0.87 MET (0.33) METALDH1A1HPGDF2GLA
SCHEMBL534531 0.87 MET (0.33) METALDH1A1HPGDF2GLA
SCHEMBL534532 0.87 MET (0.33) METALDH1A1HPGDF2GLA
SCHEMBL3728629 0.86 ALDH1A1 (0.33) METALDH1A1HPGDF2GLA
SCHEMBL3735835 0.86 ALDH1A1 (0.34) METALDH1A1HPGDF2GLA
SCHEMBL3730552 0.86 SCN9A (0.39) METALDH1A1HPGDF2GLA

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 MET 780/4885ALDH1A1 109/4885HPGD 2661/4885

“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.