SCHEMBL17189093

SCHEMBL17189093

NC(=O)[C@@H]1CNC[C@H](C(=O)O)O1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ NOS2 P35228 1/20 0.30

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
SCHEMBL16653876 0.77 KDM4E (0.31) KDM4EMAPTKMT2AATMCYP2D6
SCHEMBL23091604 0.74 PPP5C (0.31) —
SCHEMBL28157840 0.74 — —
SCHEMBL29777342 0.74 PPP5C (0.31) —
SCHEMBL30427247 0.74 PPP5C (0.31) —
Hydrochloric Acid SCHEMBL23628632 0.72 — —
SCHEMBL25661145 0.72 GABRR1 (0.36) KDM4EKMT2ACYP2D6
SCHEMBL25661144 0.72 GABRR1 (0.36) KDM4EKMT2ACYP2D6
SCHEMBL6649079 0.68 — —
SCHEMBL14506020 0.68 — —

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
EP-2933248-A1 NOVEL RENIN INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2015-10-21 — — EP disclosed
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