SCHEMBL16258118

SCHEMBL16258118

CCCCOCC1O[C@H](OCCCC)C(O[C@H]2OC(COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)C(O)C2OC(=O)c2ccccc2)C(OCCCC)[C@@H]1OCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GJB2 P29033 4/20 0.40
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
NT5E P21589 1/20 0.37
PTPN1 P18031 1/20 0.37
XDH P47989 1/20 0.36
SSTR1 P30872 1/20 0.36
SSTR2 P30874 1/20 0.36
SSTR4 P31391 1/20 0.36
SSTR3 P32745 1/20 0.36
SSTR5 P35346 1/20 0.36
TNF P01375 2/20 0.36
LGALS9 O00182 1/20 0.36
LGALS1 P09382 1/20 0.36
LGALS3 P17931 1/20 0.36
LGALS7; LGALS7B P47929 1/20 0.36
MAOB P27338 1/20 0.35
GAPDH P04406 1/20 0.35

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
SCHEMBL16258134 0.91 PTPN1 (0.42) MEN1USP2POLBKMT2APTPN1
SCHEMBL16316484 0.89 TSHR (0.39) GJB2MEN1USP2POLBKMT2A
SCHEMBL18653418 0.89 GJB2 (0.42) GJB2NT5EPTPN1SSTR1SSTR2
SCHEMBL15966260 0.86 ANTXR2 (0.42) MEN1USP2POLBKMT2APTPN1
SCHEMBL15966237 0.84 MAOB (0.45) MEN1USP2POLBKMT2APTPN1
SCHEMBL14413572 0.84 PTPN1 (0.51) MEN1USP2POLBKMT2APTPN1
SCHEMBL17087680 0.83 SSTR1 (0.45) GJB2NT5EPTPN1SSTR1SSTR2
SCHEMBL14838203 0.83 LMNA (0.40) MEN1USP2POLBKMT2APTPN1
SCHEMBL14685786 0.83 LGALS3 (0.47) MEN1USP2POLBKMT2APTPN1
SCHEMBL12454166 0.83 LGALS3 (0.47) MEN1USP2POLBKMT2APTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720889-B1 SULFATED OLIGOSACCHARIDE DERIVATIVES PROGEN PHARMACEUTICALS LTD (AU) 2014-11-26 EP disclosed