SCHEMBL20879974

SCHEMBL20879974

CC(=O)[C@H]1CCCC[C@H]1C(=O)N(N)CCCN(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.34
▸ CTSB P07858 1/20 0.34
▸ CTSS P25774 1/20 0.34
▸ CTSK P43235 1/20 0.34
▸ LMNA P02545 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ EPHX1 P07099 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
SCHEMBL19849360 1.00 SIGMAR1 (0.34) SIGMAR1CTSBCTSSCTSKLMNA
SCHEMBL24098244 0.85 KMT2A (0.35) SIGMAR1CTSBCTSSCTSKLMNA
SCHEMBL14981005 0.82 CTSB (0.33) CTSBCTSSCTSKEPHX1
SCHEMBL14708929 0.82 CTSB (0.33) CTSBCTSSCTSKEPHX1
SCHEMBL12799762 0.81 SIGMAR1 (0.34) SIGMAR1CTSBCTSSCTSKLMNA
SCHEMBL24098242 0.79 CTSB (0.35) SIGMAR1CTSBCTSSCTSKLMNA
SCHEMBL20879992 0.79 CYP1A2 (0.37) SIGMAR1
SCHEMBL12900874 0.79 CYP1A2 (0.37) SIGMAR1
SCHEMBL23020579 0.78 KMT2A (0.37) SIGMAR1CTSBCTSSCTSKLMNA
SCHEMBL12900866 0.78 KMT2A (0.37) SIGMAR1CTSBCTSSCTSKLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3782649-A1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS Ascendis Pharma A/S (DK) 2021-02-24 — — EP disclosed
EP-2459220-B1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS ASCENDIS PHARMA AS (DK) 2020-09-09 — — EP disclosed
EP-2237799-B1 PRODRUG COMPRISING A SELF-CLEAVABLE LINKER ASCENDIS PHARMA AS (DK) 2019-04-10 — — EP disclosed
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