SCHEMBL10567741

SCHEMBL10567741

ClCC1COC2(OCC(CCl)O2)O1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM3 P20309 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
SCHEMBL10568408 0.88 ALDH1A1 (0.40) ALDH1A1TDP1
SCHEMBL10572581 0.87 ALDH1A1 (0.36) ALDH1A1TDP1
SCHEMBL150257 0.75
SCHEMBL1204186 0.75
SCHEMBL1077396 0.75
SCHEMBL24079288 0.75
SCHEMBL15256825 0.74 GRIN1 (0.36) CHRM2CHRM4CHRM5CHRM3
SCHEMBL6297982 0.72 ALDH1A1 (0.39) ALDH1A1TDP1CHRM2CHRM4CHRM5
SCHEMBL6217663 0.72 PABPC1 (0.50) ALDH1A1TDP1
SCHEMBL7100587 0.72 ALDH1A1 (0.39) ALDH1A1TDP1CHRM2CHRM4CHRM5

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-4849529-A Method for production of spiro-orthocarbonate TOAGOSEI CHEMICAL INDUSTRY, LTD. (JP) 1989-07-18 US claimed
US-4849529-A Method for production of spiro-orthocarbonate TOAGOSEI CHEMICAL INDUSTRY, LTD. (JP) 1989-07-18 US disclosed