SCHEMBL8442252

SCHEMBL8442252

CC(C)O[SiH2]CCCCOCC1CO1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
ALDH1A1 P00352 4/20 0.53
TDP1 Q9NUW8 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
MAPK1 P28482 1/20 0.37

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
SCHEMBL830652 0.95 TSHR (0.55) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL2231944 0.88 TSHR (0.48) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL9869829 0.81 TSHR (0.64) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL28627231 0.81 SMN1; SMN2 (0.53) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL28617432 0.80 SMN1; SMN2 (0.56) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL28690808 0.80 TSHR (0.49) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL17442489 0.80 ALDH1A1 (0.44) ALDH1A1
SCHEMBL6051332 0.79 SMN1; SMN2 (0.54) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL31426913 0.79 TSHR (0.52) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL28262740 0.79 TSHR (0.47) TSHRALDH1A1TDP1SMN1; SMN2MAPK1

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-5917075-A Hydrolyzable and polymerizable silanes FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG, E.V. (DE) 1999-06-29 US claimed
US-5917075-A Hydrolyzable and polymerizable silanes FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG, E.V. (DE) 1999-06-29 US disclosed