SCHEMBL8736138

SCHEMBL8736138

C=COC(=O)C(C)(C)C.C=COC(=O)CC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 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
Pivalate SCHEMBL28271779 0.86 TSHR (0.34) TSHRALDH1A1
Alcohol SCHEMBL7595942 0.85 PRKCA (0.34) TSHRALDH1A1
SCHEMBL8678717 0.85 ELANE (0.33) ALDH1A1
SCHEMBL37236 0.85
SCHEMBL15133 0.85
Ethylene SCHEMBL27714277 0.83 ELANE (0.32) ALDH1A1
Methyl Alcohol SCHEMBL29184354 0.83 ELANE (0.32) ALDH1A1
SCHEMBL11755958 0.83
Hydrochloric Acid SCHEMBL4178093 0.83
Ethylene SCHEMBL624465 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150368508-A1 COATING COMPOSITIONS AND ARTICLES MADE THEREFROM 3M INNOVATIVE PROPERTIES COMPANY 2015-12-24 US disclosed
US-5723558-A MONOMERS OR MEDICAL MATERIAL, BIOSENSORS AND COSMETICS NOF CORPORATION (JP) 1998-03-03 US disclosed
EP-0790252-A1 FUMARIC ACID DERIVATIVE AND POLYMER THEREOF NOF CORPORATION (JP) 1997-08-20 EP disclosed