SCHEMBL13324630

SCHEMBL13324630

C[C@H]1OC(=O)[C@@H]2C[C@@H]3C[C@H](N)CC[C@H]3[C@H](/C=C/c3ccc(-c4cccc(C(F)(F)F)c4)cn3)[C@H]12

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F2R P25116 20/20 0.83

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
SCHEMBL13324629 1.00 F2R (0.83) F2R
SCHEMBL12759520 0.92 F2R (0.85) F2R
SCHEMBL14375452 0.91 F2R (1.00) F2R
SCHEMBL13513129 0.90 F2R (1.00) F2R
SCHEMBL13324645 0.90 F2R (1.00) F2R
SCHEMBL15282339 0.90 F2R (1.00) F2R
SCHEMBL14203709 0.90 F2R (1.00) F2R
SCHEMBL11969013 0.90 F2R (1.00) F2R
SCHEMBL11994829 0.90 F2R (1.00) F2R
SCHEMBL11969016 0.90 F2R (1.00) F2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713999-B2 Thrombin receptor antagonists SCHERING CORPORATION (US) 2010-05-11 US disclosed
US-7713999-B2 Thrombin receptor antagonists SCHERING CORPORATION (US) 2010-05-11 US disclosed
US-7304078-B2 Thrombosis; cardiovascular disorders; restenosis; hypotensive agents; antiarrhythmia agents; antiinflamamtroy agents; central nervous system disorders SCHERING CORPORATION (US) 2007-12-04 US disclosed
US-7304078-B2 Thrombosis; cardiovascular disorders; restenosis; hypotensive agents; antiarrhythmia agents; antiinflamamtroy agents; central nervous system disorders SCHERING CORPORATION (US) 2007-12-04 US disclosed
US-20070270439-A1 THROMBIN RECEPTOR ANTAGONISTS SCHERING CORPORATION 2007-11-22 US disclosed
US-20070270439-A1 THROMBIN RECEPTOR ANTAGONISTS SCHERING CORPORATION 2007-11-22 US disclosed
US-20070179187-A1 THROMBIN RECEPTOR ANTAGONISTS SCHERING CORPORATION 2007-08-02 US disclosed
US-20070179187-A1 THROMBIN RECEPTOR ANTAGONISTS SCHERING CORPORATION 2007-08-02 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 (2 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-20070179187-A1 THROMBIN RECEPTOR ANTAGONISTS TBXA2R, BDKRB2, AGTR2 F2R 7/4885
US-20070270439-A1 THROMBIN RECEPTOR ANTAGONISTS TBXA2R, BDKRB2, AGTR2 F2R 6/4885

“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.