SCHEMBL8148480

SCHEMBL8148480

Cc1ccccc1C(=O)OC1O[C@H](CO)[C@@H](O)[C@H]1OC(=O)c1ccccc1C

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 10/20 0.52
▸ LGALS9 O00182 6/20 0.52
▸ LGALS1 P09382 6/20 0.52
▸ LGALS7; LGALS7B P47929 5/20 0.52
▸ LGALS4 P56470 4/20 0.52
▸ LGALS8 O00214 8/20 0.51
▸ POLB P06746 1/20 0.41
▸ SLC5A2 P31639 2/20 0.40
▸ SLC28A3 Q9HAS3 1/20 0.40

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
SCHEMBL6739168 0.90 LGALS3 (0.51) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL29278300 0.90 LGALS3 (0.51) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
Hydrochloric Acid SCHEMBL28792398 0.88 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL25401960 0.80 NPC1 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL28217209 0.78 TSHR (0.42) —
SCHEMBL29220896 0.76 LGALS8 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL17773535 0.74 LGALS3 (0.60) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL1736995 0.74 LGALS3 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL30398021 0.74 LGALS3 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4
SCHEMBL20009365 0.74 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS4

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
WO-2000004036-A9 PHOTOCLEAVABLE NUCLEOSIDE BASE UNIV DUKE (US) 2000-07-06 — — WO disclosed
WO-2000004036-A1 PHOTOCLEAVABLE NUCLEOSIDE BASE DUKE UNIVERSITY (US) 2000-01-27 — — WO disclosed
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