SCHEMBL10985706

SCHEMBL10985706

C=C(C)CC(OCC)OCC

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
LMNA P02545 1/20 0.35
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11479484 0.84 LMNA (0.30) LMNA
SCHEMBL11469934 0.79 HSD17B10 (0.30) HSD17B10TDP1
SCHEMBL11479496 0.78
SCHEMBL7864481 0.77 THRB (0.35) THRBLMNA
SCHEMBL20224243 0.77 THRB (0.35) THRBLMNA
SCHEMBL20212051 0.77
SCHEMBL28376672 0.75 BTN3A1 (0.35)
SCHEMBL11469192 0.75 TSHR (0.41) THRB
SCHEMBL2874716 0.74 ALDH1A1 (0.43) THRBLMNAHSD17B10TDP1
SCHEMBL1878811 0.74 ALDH1A1 (0.43) THRBLMNAHSD17B10TDP1

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-4503239-A Process for the preparation of ethylenic halogenoacetals RHONE-POULENC SANTE (FR) 1985-03-05 US disclosed
US-4209644-A PERFUMES TEIJIN LIMITED (JP) 1980-06-24 US disclosed