SCHEMBL7580435

SCHEMBL7580435

C#CCOc1cc(-n2nc3n(c2=O)CCCC3)c(Cl)cc1Cl.CCOc1nc(NC)nc(NC(=O)NS(=O)(=O)c2ccccc2C(=O)O)n1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
DHODH Q02127 16/20 0.41
MAPT P10636 1/20 0.37

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
SCHEMBL7589251 0.91 DHODH (0.36) KDM4ENPC1ALDH1A1DHODH
SCHEMBL7589580 0.89 DHODH (0.41) DHODH
Primisulfuron SCHEMBL7584198 0.86 DHODH (0.43) DHODH
SCHEMBL7584676 0.84 ALDH1A1 (0.43) KDM4ENPC1ALDH1A1MAPT
Chlorimuron Ethyl SCHEMBL7586947 0.83 DHODH (0.41) DHODH
Chlorsulfuron SCHEMBL7587554 0.83 DHODH (0.42) KDM4ENPC1ALDH1A1DHODH
Iodosulfuron SCHEMBL7581283 0.82 DHODH (0.39) DHODH
SCHEMBL7579514 0.82 DHODH (0.41) DHODH
Primisulfuron SCHEMBL7576841 0.82 DHODH (0.41) DHODH
SCHEMBL7590341 0.81 DHODH (0.35) DHODH

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-20020004457-A1 Herbicidal composition SYNGENTA PARTICIPATIONS AG (CH) 2002-01-10 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-20020004457-A1 Herbicidal composition PPOX, ALAD, DDT KDM4E 1886/4885NPC1 4238/4885ALDH1A1 812/4885

“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.