SCHEMBL5837412

SCHEMBL5837412

COC(=O)CCC1(C(=O)O)CC2C=CC1C2

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
EPHX2 P34913 5/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33

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
SCHEMBL5837608 0.92 TSHR (0.37) TSHRCYP2D6CYP2C19EPHX2CA12
SCHEMBL5838282 0.89 TSHR (0.33) TSHRCYP2D6CYP2C19EPHX2CA12
SCHEMBL5837479 0.86 CYP2D6 (0.35) TSHRCYP2D6CYP2C19EPHX2
SCHEMBL5837137 0.85 CYP2D6 (0.35) CYP2D6CYP2C19
SCHEMBL5837786 0.84 ADAM17 (0.33) TSHRCYP2D6CYP2C19EPHX2CA12
SCHEMBL5837266 0.83 CYP2D6 (0.34) CYP2D6CYP2C19
SCHEMBL8613885 0.83 CYP2D6 (0.38) CYP2D6CYP2C19
SCHEMBL5838040 0.81 TSHR (0.37) TSHRCYP2D6CYP2C19EPHX2CA12
SCHEMBL32689218 0.80 CYP2D6 (0.41) CYP2D6CYP2C19
SCHEMBL5837547 0.80 CYP2D6 (0.33) 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