SCHEMBL23020573

SCHEMBL23020573

CC(=O)[C@H]1CCCC[C@H]1C(=O)N(N)CCN1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HRH3 Q9Y5N1 6/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CHRM2 P08172 3/20 0.33
▸ CHRM4 P08173 3/20 0.33
▸ CHRM5 P08912 3/20 0.33
▸ CHRM1 P11229 3/20 0.33
▸ CHRM3 P20309 3/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL21974892 1.00 L3MBTL1 (0.37) L3MBTL1HRH3NPC1LMNAMAPK1
SCHEMBL9887647 0.99 L3MBTL1 (0.34) L3MBTL1HRH3NPC1LMNAMAPK1
SCHEMBL9887646 0.99 L3MBTL1 (0.34) L3MBTL1HRH3NPC1LMNAMAPK1
SCHEMBL14980975 0.99 L3MBTL1 (0.34) L3MBTL1HRH3NPC1LMNAMAPK1
SCHEMBL20879992 0.92 CYP1A2 (0.37) L3MBTL1HRH3NPC1MAPK1MAPT
SCHEMBL12900874 0.92 CYP1A2 (0.37) L3MBTL1HRH3NPC1MAPK1MAPT
SCHEMBL23955947 0.88 SIGMAR1 (0.36) MAPTALDH1A1CHRM5CHRM3SIGMAR1
SCHEMBL20879964 0.88 KMT2A (0.38) MAPTALDH1A1TP53
SCHEMBL23955948 0.88 SIGMAR1 (0.36) MAPTALDH1A1CHRM5CHRM3SIGMAR1
SCHEMBL24098133 0.88 SIGMAR1 (0.41) HRH3ALDH1A1CYP1A2SIGMAR1

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-3782649-A1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS Ascendis Pharma A/S (DK) 2021-02-24 — — EP disclosed
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