SCHEMBL4257620

SCHEMBL4257620

CCOC(=O)CCC12C=CC(CC1C)C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
EPHX2 P34913 11/20 0.37
CYP1A2 P05177 1/20 0.33
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
NR1I2 O75469 1/20 0.31
PGR P06401 1/20 0.31
ADORA3 P0DMS8 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
SCHEMBL11756199 0.72 GAA (0.32) MGAMGAASIMGAM2
Propionic Acid SCHEMBL4257622 0.72 FFAR3 (0.32) CYP2D6CYP2C19
SCHEMBL17385970 0.71 CYP1A2 (0.38) CYP1A2
SCHEMBL4257617 0.70 CYP2D6 (0.36) USP2ALDH1A1ALOX15TDP1EPHX2
SCHEMBL5075110 0.70 GABRR1 (0.33) CYP1A2
SCHEMBL4264184 0.70 ALDH1A1 (0.38) USP2ALDH1A1ALOX15TDP1EPHX2
SCHEMBL15189250 0.69 MEN1 (0.51) ALDH1A1EPHX2LMNA
SCHEMBL5837479 0.69 CYP2D6 (0.35) USP2ALDH1A1ALOX15TDP1EPHX2
SCHEMBL5837476 0.69 CYP2D6 (0.35) USP2ALDH1A1ALOX15TDP1EPHX2
SCHEMBL5837298 0.67 EPHX2 (0.35) USP2ALDH1A1ALOX15TDP1EPHX2

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
US-20090292088-A1 PROCESS FOR PRODUCTION OF CYCLIC OLEFIN ADDITION POLYMER JSR CORPORATION (JP) 2009-11-26 US disclosed
EP-1961774-A1 PROCESS FOR PRODUCTION OF CYCLIC OLEFIN ADDITION POLYMER JSR Corporation (JP) 2008-08-27 EP disclosed