SCHEMBL11054973

SCHEMBL11054973

O=C(OCCO)C(OCCO)=C(OCCO)OCCO

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ACHE P22303 1/20 0.32
MAPK1 P28482 1/20 0.30

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
SCHEMBL2802719 0.87 ACHE (0.36) TSHRACHE
SCHEMBL1630735 0.80 TSHR (0.39) TSHRACHEMAPK1
SCHEMBL468011 0.78 TSHR (0.50) TSHRACHEMAPK1
Ethylene Glycol SCHEMBL27957390 0.75 TSHR (0.48) TSHRACHEMAPK1
SCHEMBL27624206 0.75 TSHR (0.48) TSHRACHEMAPK1
SCHEMBL12565658 0.73 TSHR (0.46) TSHRACHEMAPK1
SCHEMBL468034 0.70
SCHEMBL1532808 0.70 TSHR (0.44) TSHRACHEMAPK1
SCHEMBL7397832 0.70 TSHR (0.44) TSHRACHEMAPK1
SCHEMBL28156133 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4467027-A O-QUINONEDIAZIDE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-08-21 US disclosed
EP-0067001-A2 Developer composition KONICA CORPORATION (JP) 1982-12-15 EP disclosed