SCHEMBL7788007

SCHEMBL7788007

CC(=O)NC(C)[Si](OC(C)C)(OC(C)C)OC(C)C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
MTNR1A P48039 3/20 0.31
MTNR1B P49286 3/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
ALOX15 P16050 1/20 0.30
NFKB1 P19838 1/20 0.30
PTGS2 P35354 1/20 0.30
THPO P40225 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ACACB O00763 4/20 0.30
ACACA Q13085 2/20 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
SCHEMBL7790224 0.79 ALDH1A1 (0.35) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL7791576 0.74 MTNR1A (0.36) ALDH1A1TRPV1MTNR1AMTNR1BACACB
SCHEMBL12435119 0.64 ALDH1A1 (0.37) ALDH1A1TRPV1KDM4EMAPTTHRB
SCHEMBL12344320 0.64 ALDH1A1 (0.37) ALDH1A1TRPV1KDM4EMAPTTHRB
SCHEMBL11911982 0.64 ALDH1A1 (0.37) ALDH1A1TRPV1KDM4EMAPTTHRB
SCHEMBL3621965 0.64 TSHR (0.38) ALDH1A1TSHRTRPV1MTNR1AMTNR1B
SCHEMBL14157901 0.63 TRPV1 (0.46) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL13692 0.63
SCHEMBL3392039 0.63 KDM4E (0.50) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL7787973 0.62 TSHR (0.32) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885895-B1 N-[omega-(methyl),omega-(silyl)]alkyl-N-organocarboxamide, their oligomers and polycondensates, process for their preparation and their use DEGUSSA (DE) 2001-11-07 EP disclosed
US-6020448-A N-[ω-(methyl),ω-(silyl)] alkyl-N-organocarboxamides, oligomeric and polycondensed Si-containing compounds thereof, processes for their preparation, and their use HUELS AKTIENGESELLSCHAFT (DE) 2000-02-01 US disclosed
EP-0885895-A2 N-[omega-(methyl),omega-(silyl)]alkyl-N-organocarboxamide, their oligomers and polycondensates, process for their preparation and their use HÜLS AKTIENGESELLSCHAFT (DE) 1998-12-23 EP disclosed