SCHEMBL8048262

SCHEMBL8048262

CCCCCCCCCCCCCCCCO[Si](O)(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
LMNA P02545 3/20 0.45
ALDH1A1 P00352 2/20 0.45
LTA4H P09960 1/20 0.43
CYP3A4 P08684 2/20 0.42
TP53 P04637 2/20 0.42
MAPK1 P28482 1/20 0.42
NR5A1 Q13285 1/20 0.41
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
CHRM2 P08172 1/20 0.41
ADRA2A P08913 1/20 0.41
MAPT P10636 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR2B P41595 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SOAT1 P35610 1/20 0.40
FAAH O00519 1/20 0.40

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
SCHEMBL8034448 1.00 TSHR (0.45) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL2473998 0.93 LTA4H (0.44) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL8052071 0.91 SOAT2 (0.45) ALDH1A1SOAT1FAAH
SCHEMBL8052068 0.91 SOAT2 (0.45) ALDH1A1SOAT1FAAH
SCHEMBL1686754 0.86 TSHR (0.45) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL1686488 0.86 TSHR (0.45) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL1686749 0.86 TSHR (0.45) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL1687034 0.86 TSHR (0.45) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL1686936 0.86 TSHR (0.45) TSHRLMNAALDH1A1LTA4HCYP3A4
SCHEMBL1686459 0.84 LTA4H (0.44) TSHRLMNAALDH1A1LTA4HCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0558449-B1 Complexes of chelating ligands and process for their preparation NOVARTIS AG (CH) 2000-09-06 EP disclosed
US-5686439-A Chelate complexes and processes for their preparation NOVARTIS CORPORATION (US) 1997-11-11 US disclosed
US-5670491-A Chelate complexes and processes for their preparation CIBA-GEIGY CORPORATION (US) 1997-09-23 US disclosed
US-5358940-A Chelate complexes and processes for their preparation CIBA-GEIGY CORPORATION (US) 1994-10-25 US disclosed
EP-0558449-A1 Complexes of chelating ligands and process for their preparation CIBA-GEIGY AG (CH) 1993-09-01 EP disclosed