SCHEMBL6855032

SCHEMBL6855032

O=C(OCC1c2ccccc2-c2ccccc21)N1C[C@H](CO)[C@@H](CO)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
FABP5 Q01469 3/20 0.45
FABP7 O15540 2/20 0.45
EPHX2 P34913 1/20 0.43
F10 P00742 2/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
GBA1 P04062 1/20 0.38
MDM4 O15151 1/20 0.37
TP53 P04637 1/20 0.37
CASP3 P42574 1/20 0.37

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
SCHEMBL7926629 1.00 KMT2A (0.46) KMT2AFABP5FABP7EPHX2F10
SCHEMBL14438582 0.93 KMT2A (0.43) KMT2AFABP5FABP7EPHX2F10
SCHEMBL12292634 0.93 KMT2A (0.43) KMT2AFABP5FABP7EPHX2F10
SCHEMBL7920813 0.86 KMT2A (0.46) KMT2AFABP5FABP7EPHX2F10
SCHEMBL7920816 0.86 KMT2A (0.46) KMT2AFABP5FABP7EPHX2F10
SCHEMBL12292636 0.85 FABP5 (0.45) KMT2AFABP5FABP7EPHX2F10
SCHEMBL119453 0.84 FABP5 (0.52) KMT2AFABP5FABP7EPHX2F10
SCHEMBL30491856 0.83 KMT2A (0.44) KMT2AFABP5FABP7EPHX2F10
SCHEMBL13327274 0.83 POLB (0.52) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL22397770 0.83 POLB (0.52) KMT2AFABP5FABP7EPHX2CA1

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
US-6828427-B1 Oligomeric aminodiol-containing compounds, libraries thereof, and process of preparing the same ISIS PHARMACEUTICALS, INC. 2004-12-07 US disclosed
US-6184389-B1 FEATURE A PLURALITY OF FUNCTIONAL GROUPS ATTACHED TO BACKBONE AND PHOSPHORAMIDATE SITES ISIS PHARMACEUTICALS, INC. 2001-02-06 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