SCHEMBL6064591

SCHEMBL6064591

CCCO[Si](CCCCOCC1CO1)(OCC)OCCC

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
TDP1 Q9NUW8 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
TSHR P16473 2/20 0.53
MAPK1 P28482 1/20 0.34
SPHK2 Q9NRA0 1/20 0.31
PDK1 Q15118 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
SCHEMBL5597054 1.00 ALDH1A1 (0.57) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL6064420 1.00 ALDH1A1 (0.57) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL6064312 0.95 SMN1; SMN2 (0.57) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL6063414 0.95 SMN1; SMN2 (0.57) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL188033 0.95 ALDH1A1 (0.62) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL22974970 0.95 ALDH1A1 (0.62) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL27850034 0.94 ALDH1A1 (0.65) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL188319 0.94 TSHR (0.60) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL10590092 0.94 TSHR (0.60) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1
SCHEMBL6064397 0.93 ALDH1A1 (0.53) ALDH1A1TDP1SMN1; SMN2TSHRMAPK1

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
US-7141306-B1 Sol-gel composition and process for coating aerospace alloys CESSNA AIRCRAFT COMPANY (US) 2006-11-28 US disclosed