SCHEMBL5837258

SCHEMBL5837258

CC(C)OC(=O)C1(CC(=O)O)CC2C=CC1C2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
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
SCHEMBL5838301 0.86 SMN1; SMN2 (0.32) CYP2D6CYP2C19SMN1; SMN2
SCHEMBL5836347 0.84 CYP2D6 (0.35) CYP2D6CYP2C19
SCHEMBL5837506 0.82 CYP2D6 (0.36) CYP2D6CYP2C19SMN1; SMN2
SCHEMBL5836953 0.81 CYP2D6 (0.35) CYP2D6CYP2C19SMN1; SMN2
SCHEMBL5838268 0.81 CYP2D6 (0.33) CYP2D6CYP2C19
SCHEMBL5836209 0.80 CYP2D6 (0.35) CYP2D6CYP2C19
SCHEMBL24703372 0.79 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL11757692 0.79 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL75380 0.79 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL11755065 0.79 CYP2D6 (0.36) CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100386357-C Norbornene-based ring-opening polymerization polymer, product of hydrogenation of norbornene-based ring-opening polymerization polymer, and processes for producing these ZEON CORP (JP) 2008-05-07 CN disclosed
US-7037993-B2 Norbornene-based ring-opening polymerization polymer, product of hydrogenation of norbornene-based ring-opening polymerization polymer, and processes for producing these ZEON CORPORATION (JP) 2006-05-02 US disclosed
CN-1659205-A Norbornene-based ring-opening polymer, hydrogenation product of norbornene-based ring-opening polymer, and method for producing same ZEON CORP (JP) 2005-08-24 CN disclosed
US-20050148746-A1 Norbornene-based ring-opening polymerization polymer, product of hydrogenation of norbornene-based ring-opening polymerization polymer, and processes for producing these ZEON CORPORATION (JP) 2005-07-07 US disclosed