SCHEMBL6849952

SCHEMBL6849952

COC(OC)(OC(c1ccccc1)(c1ccccc1)c1ccccc1)C1CN(C(=O)OCC2c3ccccc3-c3ccccc32)CC1CO

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.37
F10 P00742 2/20 0.36
FABP7 O15540 2/20 0.35
MDM4 O15151 1/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 2/20 0.34
EPHX2 P34913 1/20 0.32
CASP3 P42574 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL6858226 1.00 FABP5 (0.37) FABP5F10FABP7MDM4TP53
SCHEMBL6858228 1.00 FABP5 (0.37) FABP5F10FABP7MDM4TP53
Succinic Acid SCHEMBL6855629 0.84 KMT2A (0.38) FABP5F10FABP7MDM4TP53
SCHEMBL8732800 0.81 FABP5 (0.37) FABP5FABP7MDM4TP53KMT2A
Phosphonic Acid SCHEMBL6854647 0.80 F10 (0.34) FABP5F10FABP7MDM4TP53
SCHEMBL7926629 0.80 KMT2A (0.46) FABP5F10FABP7MDM4TP53
SCHEMBL6855032 0.80 KMT2A (0.46) FABP5F10FABP7MDM4TP53
Hypophosphorous Acid SCHEMBL7923595 0.79 FABP5 (0.32) FABP5F10FABP7MDM4TP53
SCHEMBL6855668 0.79 FABP5 (0.37) FABP5FABP7MDM4TP53KMT2A
SCHEMBL6858060 0.79 FABP5 (0.37) FABP5FABP7MDM4TP53KMT2A

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
US-6828427-B1 Oligomeric aminodiol-containing compounds, libraries thereof, and process of preparing the same ISIS PHARMACEUTICALS, INC. 2004-12-07 US disclosed
EP-0865439-A4 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS INC (US) 1998-11-11 EP disclosed
EP-0865439-A1 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS, INC. (US) 1998-09-23 EP disclosed
WO-1996040672-A1 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed