SCHEMBL3203760

SCHEMBL3203760

NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)C1CCCN1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.45

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
SCHEMBL3203779 1.00 KDM1A (0.45) KDM1A
SCHEMBL29936455 0.90 OPRM1 (0.50) —
SCHEMBL30818415 0.89 OPRM1 (0.53) —
SCHEMBL31053725 0.84 REN (0.56) —
SCHEMBL29591954 0.83 SLC6A2 (0.57) —
SCHEMBL30974248 0.82 REN (0.51) —
SCHEMBL29590910 0.81 SLC6A2 (0.56) KDM1A
SCHEMBL17722501 0.81 OPRM1 (0.47) —
SCHEMBL31362679 0.81 SLC6A2 (0.56) —
SCHEMBL31665963 0.81 REN (0.53) —

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-20100047762-A1 METHOD TO MONITOR DRUG EFFICACY IN DIABETIC PATIENTS USING AN ASSAY FOR 1,5-ANHYDRO-D-GLUCITOL NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-02-25 — — US disclosed
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