SCHEMBL4172894

SCHEMBL4172894

C=C(COCC(=C)C(O)CC)C(O)CC

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39

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
SCHEMBL4109384 0.77
SCHEMBL3651955 0.77
SCHEMBL3240626 0.72 MEN1 (0.33)
SCHEMBL28070074 0.72
SCHEMBL28977830 0.70
SCHEMBL9791264 0.69 CDK1 (0.32)
SCHEMBL1218404 0.67 TSHR (0.43) TSHR
SCHEMBL23925665 0.67 CES1 (0.36) TSHR
SCHEMBL4951179 0.65
SCHEMBL13555483 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-54117415-A None JP disclosed
US-20090087689-A1 MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-6936328-B2 Magnetic recording medium FUJI PHOTO FILM CO., LTD. (JP) 2005-08-30 US disclosed
US-20030180578-A1 Magnetic recording medium FUJI PHOTO FILM CO., LTD. 2003-09-25 US disclosed
JP-S54117415-A SYNTHESIS OF OH-CONTAINING ETHERS RIKEN VITAMIN CO LTD 1979-09-12 JP disclosed