SCHEMBL8771027

SCHEMBL8771027

C=CCC(OCC1CO1)C1CO1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
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
Ammonia Solution, Strong SCHEMBL7713247 0.79 ALDH1A1 (0.38) ALDH1A1
SCHEMBL3402458 0.78 TDP1 (0.35) ALDH1A1
SCHEMBL14646001 0.77 TSHR (0.55) ALDH1A1TSHR
SCHEMBL7695983 0.76
SCHEMBL4954464 0.76
SCHEMBL6466036 0.75
SCHEMBL32679905 0.75
Oxirane SCHEMBL6300592 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8652539 0.73 ALDH1A1 (0.38) ALDH1A1
Propylene Oxide SCHEMBL1905554 0.72 ALDH1A1 (0.31) ALDH1A1

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
EP-0635522-B1 Vulcanizable compositions based on modified acrylic rubbers ENICHEM SPA (IT) 1997-09-24 EP claimed