SCHEMBL28468397

SCHEMBL28468397

C=CC(=O)OC1(CC)COCO1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
HPGD P15428 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
SCHEMBL30170457 0.88 TSHR (0.37) TSHRHPGD
SCHEMBL28655050 0.77 TSHR (0.34) TSHRHPGD
SCHEMBL27975507 0.75 HPGD (0.31) TSHRHPGD
SCHEMBL5028522 0.73 TSHR (0.36) TSHRHPGD
SCHEMBL5708458 0.71 HPGD (0.30) TSHRHPGD
SCHEMBL27907045 0.70
SCHEMBL27909880 0.69 TSHR (0.37) TSHRHPGD
SCHEMBL21829139 0.69 TSHR (0.33) TSHRHPGD
SCHEMBL1897284 0.69 PRKCA (0.37) TSHRHPGD
SCHEMBL12902857 0.68 TSHR (0.33) TSHRHPGD

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
CN-111630019-A Curable organopolysiloxane composition 瓦克化学股份公司 2020-09-04 CN disclosed