SCHEMBL20879964

SCHEMBL20879964

CC(=O)[C@@H]1CCCC[C@@H]1C(=O)N(N)CCN1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.38
▸ GAA P10253 2/20 0.37
▸ EPHX1 P07099 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ DUSP3 P51452 1/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PAOX Q6QHF9 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TP53 P04637 1/20 0.34

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
SCHEMBL12900871 1.00 KMT2A (0.38) KMT2AGAAEPHX1ALDH1A1TSHR
SCHEMBL9887646 0.89 L3MBTL1 (0.34) ALDH1A1MAPTTP53
SCHEMBL14980975 0.89 L3MBTL1 (0.34) ALDH1A1MAPTTP53
SCHEMBL9887647 0.89 L3MBTL1 (0.34) ALDH1A1MAPTTP53
SCHEMBL23020573 0.88 L3MBTL1 (0.37) ALDH1A1MAPTTP53
SCHEMBL21974892 0.88 L3MBTL1 (0.37) ALDH1A1MAPTTP53
SCHEMBL24098133 0.84 SIGMAR1 (0.41) EPHX1ALDH1A1KDM4EDUSP3PTPN11
SCHEMBL23955948 0.84 SIGMAR1 (0.36) KMT2AALDH1A1MEN1MAPT
SCHEMBL23955947 0.84 SIGMAR1 (0.36) KMT2AALDH1A1MEN1MAPT
SCHEMBL9887637 0.84 SIGMAR1 (0.36) KMT2AALDH1A1MEN1MAPT

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-3922267-A1 PEGYLATED RECOMBINANT HUMAN GROWTH HORMONE COMPOUNDS ASCENDIS PHARMA ENDOCRINOLOGY DIVISION A/S (DK) 2021-12-15 — — 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
Send feedback