SCHEMBL6436889

SCHEMBL6436889

CC(C)(C)[Si](C)(C)OC(C(=O)O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRN P28799 6/20 0.36
SORT1 Q99523 6/20 0.36
APP P05067 2/20 0.33
PPARG P37231 5/20 0.33
PPARA Q07869 3/20 0.33
TPMT P51580 1/20 0.32
CYP3A4 P08684 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
CASP3 P42574 1/20 0.30
KMT2A Q03164 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
KDM4C Q9H3R0 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
SCHEMBL6436887 1.00 GRN (0.36) GRNSORT1APPPPARGPPARA
SCHEMBL8310048 0.85 MEN1 (0.41) PPARGPPARAMEN1KMT2A
SCHEMBL8310050 0.85 MEN1 (0.41) PPARGPPARAMEN1KMT2A
SCHEMBL7570004 0.84 PPARG (0.44) PPARGPPARACYP3A4MEN1POLB
SCHEMBL7567010 0.79 ATM (0.42) PPARGPPARACYP3A4KMT2A
SCHEMBL3232420 0.79 ATM (0.42) PPARGPPARACYP3A4KMT2A
SCHEMBL8405171 0.79 ATM (0.42) PPARGPPARACYP3A4KMT2A
SCHEMBL11125232 0.74 ALDH1A1 (0.40) GRNSORT1APPPPARGPPARA
SCHEMBL6439346 0.74 CA2 (0.35)
SCHEMBL6439350 0.74 CA2 (0.35)

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-1087943-B1 THERAPEUTIC BIARYL DERIVATIVES GLAXO GROUP LTD (GB) 2005-08-17 EP disclosed
US-6251925-B1 AN AGONISTS FOR HUMAN BETA-3 ADRENOCEPTOR GLAXO WELLCOME INC. 2001-06-26 US disclosed
EP-1087943-A1 THERAPEUTIC BIARYL DERIVATIVES GLAXO GROUP LIMITED (GB) 2001-04-04 EP disclosed
WO-1999065877-A1 THERAPEUTIC BIARYL DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-12-23 WO disclosed