SCHEMBL11272031

SCHEMBL11272031

CCC(C)(O)C#CC(O)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL11619817 0.91
SCHEMBL1704294 0.82
SCHEMBL28964077 0.79
SCHEMBL9788479 0.78
SCHEMBL16154682 0.74
SCHEMBL127300 0.72 TSHR (0.38) TSHR
SCHEMBL8165309 0.71
SCHEMBL4845594 0.70
SCHEMBL11111398 0.68 TSHR (0.33) TSHR
SCHEMBL5431371 0.66

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-0049358-A1 Strontium and barium containing alkoxylation systems for unsaturated alcohols Conoco Phillips Company (US) 1982-04-14 EP disclosed
US-4054592-A Urethanes containing two perfluoroalkylthio groups CIBA-GEIGY CORPORATION (US) 1977-10-18 US disclosed
US-4001305-A POLYURETHANES, OIL AND WATER REPELLANT, MOLD-RELEASE CIBA-GEIGY CORPORATION (US) 1977-01-04 US disclosed
US-3935277-A OIL AND WATER REPELLENT INTERMEDIATES CIBA-GEIGY CORPORATION (US) 1976-01-27 US disclosed