SCHEMBL1759454

SCHEMBL1759454

CCO[Si](C)(CNC1CCCCC1)OCC.CCO[Si](CCCOCC1CO1)(OCC)OCC

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL515299 0.82 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL16430091 0.82 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL20478200 0.82 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL8605595 0.82 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL44112 0.82 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL25222466 0.81 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1TSHR
Hydrochloric Acid SCHEMBL31440173 0.81 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1TSHR
Ammonia Solution, Strong SCHEMBL28703768 0.81 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL7887783 0.79 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL25282146 0.79 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1TDP1TSHR

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
EP-2499203-A1 COMPOSITE PARTICLE HAVING ORGANIC AND INORGANIC DOMAINS Wacker Chemie AG (DE) 2012-09-19 EP disclosed
WO-2011058051-A1 COMPOSITE PARTICLE HAVING ORGANIC AND INORGANIC DOMAINS WACKER CHEMIE AG (DE) 2011-05-19 WO disclosed