SCHEMBL2790167

SCHEMBL2790167

C[C@H](NC(=O)[C@H](C)NC(=O)C(N)CCP(C)(=O)O)C(=O)O.[NaH]

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.37
GLUL P15104 1/20 0.37
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
GCLC P48506 1/20 0.37
MME P08473 1/20 0.37
ANPEP P15144 1/20 0.37
GRM8 O00222 1/20 0.36
GRM6 O15303 1/20 0.36
GRM7 Q14831 1/20 0.36
GRM4 Q14833 1/20 0.36

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
SCHEMBL1202986 1.00 LTA4H (0.37) LTA4HGLULDPP4DPP8DPP9
SCHEMBL10745013 1.00 LTA4H (0.37) LTA4HGLULDPP4DPP8DPP9
SCHEMBL29592595 0.98 GLUL (0.38) LTA4HGLULDPP4DPP8DPP9
SCHEMBL18706 0.98 GLUL (0.38) LTA4HGLULDPP4DPP8DPP9
SCHEMBL3634376 0.98 GLUL (0.38) LTA4HGLULDPP4DPP8DPP9
SCHEMBL54688 0.98 GLUL (0.38) LTA4HGLULDPP4DPP8DPP9
SCHEMBL910217 0.98 GLUL (0.38) LTA4HGLULDPP4DPP8DPP9
Phosphinothricin SCHEMBL5601699 0.96 GLUL (0.43) GLULGCLCGRM8GRM6GRM7
Glufosinate SCHEMBL7468438 0.96 GLUL (0.43) GLULGCLCGRM8GRM6GRM7
SCHEMBL9859876 0.95 GLUL (0.40) LTA4HGLULDPP4DPP8DPP9

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
EP-0462585-B1 Herbicidal composition ISHIHARA SANGYO KAISHA (JP) 1996-01-17 EP claimed
EP-0462585-A1 Herbicidal composition ISHIHARA SANGYO KAISHA, LTD. (JP) 1991-12-27 EP claimed
US-20100069249-A1 HERBICIDE COMBINATION COMPRISING DIMETHOXYTRIAZINYL-SUBSTITUTED DIFLUOROMETHANESULFONYLANILIDES BAYER CROPSCIENCE AG (DE) 2010-03-18 US disclosed
WO-2010017924-A2 HERBICIDAL COMBINATION COMPRISING DIMETHOXYTRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES BAYER CROPSCIENCE AG (DE) 2010-02-18 WO disclosed
EP-0729701-A2 Method for controlling harmful living organisms ROHM AND HAAS COMPANY (US) 1996-09-04 EP 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-20100069249-A1 HERBICIDE COMBINATION COMPRISING DIMETHOXYTRIAZINYL-SUBSTITUTED DIFLUOROMETHANESULFONYLANILIDES PFAS, AGPS, DDT LTA4H 2964/4885GLUL 14/4885DPP4 322/4885

“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.