SCHEMBL8464853

SCHEMBL8464853

CCO[Si](C)(CC(C)C)OC(C)Nc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.38
ALDH1A1 P00352 4/20 0.36
CYP3A4 P08684 3/20 0.36
ALOX15 P16050 3/20 0.36
TSHR P16473 3/20 0.36
HSD17B10 Q99714 3/20 0.36
ALOX12 P18054 2/20 0.36
HIF1A Q16665 2/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 2/20 0.34
THRB P10828 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
RECQL P46063 1/20 0.34
ATM Q13315 1/20 0.34
GAA P10253 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CAPN1 P07384 1/20 0.31
KCNH3 Q9ULD8 1/20 0.31

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
SCHEMBL28041978 0.82 TDP1 (0.35) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL16553237 0.81 TDP1 (0.42) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL27658984 0.81 TDP1 (0.42) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL303194 0.75 TDP1 (0.39) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL303375 0.73
SCHEMBL27763136 0.72 TDP1 (0.42) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL28735539 0.71 TDP1 (0.45) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL27245488 0.70 ALDH1A1 (0.45) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL10696330 0.70 TDP1 (0.52) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL1889198 0.70 MAPT (0.41) TDP1ALDH1A1GAANPSR1SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0676403-B1 Arylaminosilane end-capped urethane sealants WITCO CORP (US) 1999-09-15 EP claimed
EP-0676403-A1 Arylaminosilane end-capped urethane sealants OSI SPECIALTIES, INC. (US) 1995-10-11 EP claimed
EP-0676403-B1 Arylaminosilane end-capped urethane sealants WITCO CORP (US) 1999-09-15 EP disclosed
EP-0676403-A1 Arylaminosilane end-capped urethane sealants OSI SPECIALTIES, INC. (US) 1995-10-11 EP disclosed