SCHEMBL18138459

SCHEMBL18138459

CC(=O)C(O[Ti](OC(C)C)(OC(C)C)OC(C)C)C(C)=O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36

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
SCHEMBL838611 1.00 TSHR (0.36) TSHR
SCHEMBL11025284 0.78 TSHR (0.35) TSHR
SCHEMBL7709549 0.75 MGAM (0.40) TSHR
SCHEMBL15774 0.74
Bicarbonate SCHEMBL9776491 0.74 CA4 (0.33) TSHR
SCHEMBL9351132 0.73 TSHR (0.31) TSHR
SCHEMBL101343 0.72 TSHR (0.43) TSHR
SCHEMBL5563567 0.71
Acetone SCHEMBL28902214 0.70 TSHR (0.42) TSHR
SCHEMBL9351116 0.70 ALDH1A1 (0.42) TSHR

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
EP-3081612-B1 PHOTOCURABLE COMPOSITION HAVING ADHESIVE PROPERTIES CEMEDINE CO LTD (JP) 2018-11-14 EP disclosed
US-9718999-B2 Photocurable composition having adhesive properties CEMEDINE CO., LTD (JP) 2017-08-01 US disclosed
US-20160312089-A1 PHOTOCURABLE COMPOSITION HAVING ADHESIVE PROPERTIES CEMEDINE CO., LTD. (JP) 2016-10-27 US disclosed
EP-3081612-A1 PHOTOCURABLE COMPOSITION HAVING ADHESIVE PROPERTIES Cemedine Co., Ltd. (JP) 2016-10-19 EP disclosed