SCHEMBL29836760

SCHEMBL29836760

O=C(O)CC1(O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 8/20 0.41
▸ PYGL P06737 3/20 0.41
▸ PYGM P11217 2/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ LMNA P02545 1/20 0.35
▸ GBA1 P04062 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
SCHEMBL8507620 1.00 PYGB (0.41) PYGBPYGLPYGMMEN1KMT2A
SCHEMBL18385978 1.00 PYGB (0.41) PYGBPYGLPYGMMEN1KMT2A
SCHEMBL3934943 0.84 PYGB (0.42) PYGBPYGLPYGMMEN1KMT2A
SCHEMBL9052851 0.82 MEN1 (0.41) PYGBPYGLPYGMMEN1KMT2A
SCHEMBL7556458 0.80 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL7553587 0.80 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL7556738 0.80 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL7554376 0.80 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL7555317 0.80 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL2785358 0.79 MEN1 (0.54) PYGBPYGLPYGMMEN1KMT2A

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
CN-114891576-A Corneal contact lens care solution, preparation method and application thereof 陕西尼得克医疗科技股份有限公司 2022-08-12 — — CN claimed
CN-114891576-A Corneal contact lens care solution, preparation method and application thereof 陕西尼得克医疗科技股份有限公司 2022-08-12 — — CN disclosed
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