SCHEMBL20165446

SCHEMBL20165446

CCOC(=O)N(CCC(=O)O)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
KDM5A P29375 2/20 0.38
PHF8 Q9UPP1 2/20 0.38
KDM2A Q9Y2K7 2/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM4A O75164 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL20166075 0.90 L3MBTL1 (0.41) L3MBTL1ALDH1A1KDM4ENPC1KDM5A
SCHEMBL10988348 0.89 ALDH1A1 (0.44) L3MBTL1ALDH1A1KDM4ENPC1LMNA
SCHEMBL1837926 0.85 ALDH1A1 (0.44) L3MBTL1ALDH1A1KDM4ENPC1LMNA
SCHEMBL10990804 0.83 ALDH1A1 (0.40) L3MBTL1ALDH1A1KDM4ENPC1LMNA
SCHEMBL28488966 0.82 NAAA (0.49) L3MBTL1ALDH1A1KDM4ENPC1LMNA
SCHEMBL31126845 0.82 CYP1A2 (0.41) L3MBTL1ALDH1A1KDM4ENPC1ATM
SCHEMBL13462953 0.82 ALDH1A1 (0.50) L3MBTL1ALDH1A1KDM4ENPC1LMNA
SCHEMBL9200042 0.80 KDM5A (0.38) L3MBTL1ALDH1A1KDM5APHF8KDM2A
SCHEMBL4460610 0.79 CYP1A2 (0.41) L3MBTL1ALDH1A1KDM5APHF8KDM2A
SCHEMBL3286934 0.78 MGAM (0.42) L3MBTL1ALDH1A1KDM4ENPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541857-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2019-09-25 EP disclosed
WO-2018091375-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 WO disclosed