SCHEMBL9891079

SCHEMBL9891079

CC=CCn1cc(Cl)c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.47
GRIA2 P42262 1/20 0.47
GRIA4 P48058 1/20 0.47
GRIK5 Q16478 1/20 0.47
TK1 P04183 10/20 0.43
TK2 O00142 2/20 0.40

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
SCHEMBL19196342 0.81 TK1 (0.62) TK1TK2
SCHEMBL9891076 0.81 TK1 (0.62) TK1TK2
SCHEMBL9891080 0.80 ALDH1A1 (0.47) GRIA1GRIA2GRIA4GRIK5TK1
SCHEMBL9891078 0.80 LMNA (0.51) GRIA1GRIA2GRIA4GRIK5TK1
SCHEMBL11254252 0.77 GRIA1 (0.53) GRIA1GRIA2GRIA4GRIK5
SCHEMBL9891087 0.74 TK1 (0.38) GRIA1GRIA2GRIA4GRIK5TK1
SCHEMBL9891088 0.74 TK1 (0.38) GRIA1GRIA2GRIA4GRIK5TK1
SCHEMBL19711624 0.74 GRIA1 (0.54) GRIA1GRIA2GRIA4GRIK5
SCHEMBL9892709 0.73 TK1 (0.37) GRIA1GRIA2GRIA4GRIK5TK1
SCHEMBL9892708 0.73 TK1 (0.37) GRIA1GRIA2GRIA4GRIK5TK1

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-8785629-B2 Phosphonates synthons for the synthesis of phosphonates derivatives showing better bioavailability CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-07-22 US disclosed
US-8785629-B2 Phosphonates synthons for the synthesis of phosphonates derivatives showing better bioavailability CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-07-22 US disclosed
US-20120142897-A1 PHOSPHONATES SYNTHONS FOR THE SYNTHESIS OF PHOSPHONATES DERIVATIVES SHOWING BETTER BIOAVAILABILITY UNIVERSITE D'ORLEANS (FR) 2012-06-07 US disclosed
US-20120142897-A1 PHOSPHONATES SYNTHONS FOR THE SYNTHESIS OF PHOSPHONATES DERIVATIVES SHOWING BETTER BIOAVAILABILITY UNIVERSITE D'ORLEANS (FR) 2012-06-07 US disclosed
EP-2270021-A1 Phosphonates synthons for the synthesis of phosphonates derivatives showing better bioavailability Centre National de la Recherche Scientifique (FR) 2011-01-05 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-20120142897-A1 PHOSPHONATES SYNTHONS FOR THE SYNTHESIS OF PHOSPHONATES DERIVATIVES SHOWING BETTER BIOAVAILABILITY PNP, PHPT1, TYMP GRIA1 3940/4885GRIA2 4071/4885GRIA4 4317/4885

“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.