SCHEMBL8540868

SCHEMBL8540868

C[C@@]12C[CH]C[C@]1(C)CC(=O)C2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL2706623 0.78 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL14016355 0.78 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL8344752 0.73 SMN1; SMN2 (0.35) SMN1; SMN2
SCHEMBL25179633 0.71
SCHEMBL2691041 0.65
SCHEMBL4859696 0.65 KDM4E (0.39) SMN1; SMN2
SCHEMBL21570661 0.65
SCHEMBL11837084 0.65 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL616425 0.65 TP53 (0.32) SMN1; SMN2
SCHEMBL38953 0.65 SMN1; SMN2 (0.56) SMN1; SMN2

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-0882044-A1 1,4-DIHYDROPYRIDINE COMPOUNDS AS BRADYKININ ANTAGONISTS PFIZER INC. (US) 1998-12-09 EP disclosed
WO-1997030048-A1 1,4-DIHYDROPYRIDINE COMPOUNDS AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 1997-08-21 WO disclosed