SCHEMBL5756191

SCHEMBL5756191

COc1ccc([C@@H]2CN(C(=O)O)C[C@@]2(C)[C@@H](C)O)cc1OCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.53
SIGMAR1 Q99720 8/20 0.46

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
SCHEMBL5759358 1.00 PDE4B (0.53) PDE4BSIGMAR1
SCHEMBL5755814 0.95 PDE4B (0.53) PDE4BSIGMAR1
SCHEMBL5755588 0.95 PDE4B (0.53) PDE4BSIGMAR1
SCHEMBL5755237 0.94 PDE4B (0.52) PDE4BSIGMAR1
SCHEMBL5754945 0.94 PDE4B (0.52) PDE4BSIGMAR1
SCHEMBL5360454 0.93 PDE4B (0.52) PDE4BSIGMAR1
SCHEMBL5362362 0.93 PDE4B (0.52) PDE4BSIGMAR1
SCHEMBL17559322 0.91 PDE4B (0.54) PDE4B
SCHEMBL5356884 0.88 PDE4B (0.51) PDE4B
SCHEMBL7361038 0.88 PDE4B (0.51) PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242400-B1 PYRROLIDINE DERIVATIVES AS CYCLIC AMP-SPECIFIC PHOSPHODIESTERASE INHIBITORS ICOS CORP (US) 2006-05-03 EP claimed