SCHEMBL14379735

SCHEMBL14379735

C[C@H]1OC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[C@H](/C=C/c3ccc(-c4cccc(F)c4)cn3)C12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F2R P25116 20/20 1.00
CNR2 P34972 1/20 0.78

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
SCHEMBL12831328 1.00 F2R (1.00) F2RCNR2
SCHEMBL471257 1.00 F2R (1.00) F2RCNR2
SCHEMBL12213245 1.00 F2R (1.00) F2RCNR2
SCHEMBL751348 0.90 F2R (0.84) F2R
SCHEMBL12759523 0.90 F2R (0.84) F2R
SCHEMBL14203720 0.90 F2R (0.84) F2R
SCHEMBL1106195 0.90 F2R (1.00) F2R
SCHEMBL6624710 0.90 F2R (1.00) F2R
SCHEMBL13324737 0.90 F2R (0.81) F2R
SCHEMBL12831686 0.89 F2R (0.82) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2399912-B1 An exo-selective synthesis of himbacine analogs MERCK SHARP & DOHME (US) 2015-02-25 EP disclosed
EP-1495018-B1 TRICYCLIC THROMBIN RECEPTOR ANTAGONISTS SCHERING CORP (US) 2007-11-14 EP disclosed