SCHEMBL16230374

SCHEMBL16230374

O=C(OC1C(F)OC(COC2OC(CO)C(OC(=O)c3ccccc3)C(OC(=O)c3ccccc3)C2OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 2/20 0.46
▸ LGALS9 O00182 1/20 0.46
▸ LGALS1 P09382 1/20 0.46
▸ LGALS7; LGALS7B P47929 1/20 0.46
▸ PTPN1 P18031 5/20 0.41
▸ SELP P16109 4/20 0.40
▸ LGALS4 P56470 1/20 0.39
▸ SELE P16581 1/20 0.39
▸ USP2 O75604 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ NT5E P21589 1/20 0.38
▸ ANTXR2 P58335 2/20 0.38
▸ TMPRSS2 O15393 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ HMGCR P04035 1/20 0.38

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
SCHEMBL16230373 0.89 LGALS9 (0.55) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL16230370 0.88 TSHR (0.51) PTPN1KMT2ACA1CA2MAPK1
SCHEMBL18654301 0.87 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18654247 0.87 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18654211 0.86 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL16230371 0.86 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL16230372 0.86 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18654342 0.85 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18654240 0.85 LGALS3 (0.46) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18654198 0.84 LGALS3 (0.45) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1

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
US-8883170-B2 Adjuvant WESTERN ILLINOIS UNIVERSITY RESEARCH FOUNDATION (US) 2014-11-11 — — US disclosed
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