SCHEMBL8332380

SCHEMBL8332380

CC(=O)N[C@@H]1[C@@H](OCc2ccccc2)O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1O[C@H](C)C(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.49
▸ PTPN1 P18031 10/20 0.48
▸ CDC25B P30305 8/20 0.48
▸ TP53 P04637 2/20 0.46
▸ MDM2 Q00987 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ PTPN2 P17706 5/20 0.45
▸ PTPN6 P29350 4/20 0.45
▸ PTPN11 Q06124 4/20 0.45
▸ TACR2 P21452 2/20 0.45
▸ NT5E P21589 1/20 0.44
▸ MDM4 O15151 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ HSP90AB1 P08238 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL8331347 0.94 POLB (0.49) POLBPTPN1CDC25BTP53MDM2
SCHEMBL8332378 0.92 POLB (0.46) POLBPTPN1CDC25BTP53MDM2
SCHEMBL11165822 0.88 PTPN1 (0.48) POLBPTPN1CDC25BTP53MDM2
SCHEMBL16967451 0.88 TP53 (0.55) POLBPTPN1CDC25BTP53MDM2
SCHEMBL5840884 0.88 TP53 (0.55) POLBPTPN1CDC25BTP53MDM2
SCHEMBL15514084 0.88 TP53 (0.55) POLBPTPN1CDC25BTP53MDM2
SCHEMBL5840927 0.88 TP53 (0.55) POLBPTPN1CDC25BTP53MDM2
SCHEMBL9473749 0.87 POLB (0.65) POLBLMNAKMT2AL3MBTL1
SCHEMBL8331345 0.86 POLB (0.46) POLBPTPN1CDC25BTP53MDM2
SCHEMBL7582210 0.85 TP53 (0.55) POLBPTPN1CDC25BTP53MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6008333-A Preparation of glucosaminyl muramic acid derivatives ENDOREX CORPORATION (US) 1999-12-28 — — US disclosed
US-5750665-A Preparation of glucosaminyl muramic acid derivatives ENDOREX CORPORATION 1998-05-12 — — US disclosed
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