SCHEMBL13774886

SCHEMBL13774886

COC(=O)[C@@H](CCP(=O)(O)C(O)c1ccc(F)c([N+](=O)[O-])c1)NC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM8 O00222 17/20 0.57
GRM4 Q14833 17/20 0.57
GRM6 O15303 15/20 0.57
GSTP1 P09211 1/20 0.45
GSTM2 P28161 1/20 0.45
GRM7 Q14831 7/20 0.44
KYNU Q16719 1/20 0.44

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
SCHEMBL4092884 1.00 GRM8 (0.57) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL8238396 0.91 GRM8 (0.56) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL4085127 0.91 GRM8 (0.58) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL13774887 0.90 GRM8 (0.57) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL8240661 0.90 GRM8 (0.61) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL4090001 0.90 GRM8 (0.59) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL10000469 0.88 GRM8 (0.55) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL13774906 0.88 GRM8 (0.59) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL13774966 0.86 GRM8 (0.53) GRM8GRM4GRM6GSTP1GSTM2
SCHEMBL13774896 0.86 GRM8 (0.53) GRM8GRM4GRM6GSTP1GSTM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170813-A1 Hypophosphorous Acid Derivatives and their Therapeutical Applications CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2009-07-02 US disclosed
US-20090170813-A1 Hypophosphorous Acid Derivatives and their Therapeutical Applications CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2009-07-02 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-20090170813-A1 Hypophosphorous Acid Derivatives and their Therapeutical Applications P4HA1, CYP2R1, EGLN3 GRM8 1667/4885GRM4 1497/4885GRM6 1170/4885

“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.