SCHEMBL20165960

SCHEMBL20165960

CCOC(=O)C(C)C(C)N(C(=O)OCC)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
ALDH1A1 P00352 6/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
METAP2 P50579 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
THRB P10828 1/20 0.34
ATM Q13315 1/20 0.34
LMNA P02545 1/20 0.33
TP53 P04637 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
SCHEMBL28903531 0.90 L3MBTL1 (0.36) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL20166090 0.84 MEN1 (0.42) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL20165444 0.81 TSHR (0.40) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL5980962 0.81 TSHR (0.40) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL31126799 0.81 CYP2D6 (0.39) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL28482934 0.78 ALDH1A1 (0.37) TSHRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL20165987 0.77 CYP2D6 (0.40) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL28488446 0.75 TSHR (0.36) TSHRL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL21522856 0.74 CYP2D6 (0.39) TSHRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL20165930 0.74 TSHR (0.37) TSHRL3MBTL1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541857-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2020-09-09 EP disclosed
US-10654946-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2020-05-19 US disclosed
US-20190330388-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-10-31 US disclosed
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