SCHEMBL20164210

SCHEMBL20164210

CCOC(=O)N(C)CCCOC(=O)c1ccc(Cl)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.70
ALDH1A1 P00352 2/20 0.54
LMNA P02545 4/20 0.48
CYP1A2 P05177 3/20 0.48
CYP2D6 P10635 2/20 0.48
CYP3A4 P08684 2/20 0.48
SCN1A P35498 2/20 0.48
SCN2A Q99250 2/20 0.48
SCN3A Q9NY46 2/20 0.48
CHRM2 P08172 1/20 0.48
HTR1A P08908 1/20 0.48
DRD3 P35462 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KCNH2 Q12809 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 3/20 0.46
TSHR P16473 3/20 0.46
CYP2C19 P33261 2/20 0.46
ESR1 P03372 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46

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
SCHEMBL20164205 0.86 TDP1 (0.58) GAAALDH1A1LMNACYP1A2CYP2D6
SCHEMBL20164297 0.85 GAA (0.50) GAAALDH1A1LMNACYP1A2CHRM2
SCHEMBL20164216 0.84 ALDH1A1 (0.52) GAAALDH1A1LMNACYP1A2CYP2D6
SCHEMBL18249445 0.81 UTS2R (0.47) GAAALDH1A1TSHRSMN1; SMN2KMT2A
SCHEMBL6057147 0.78 ESR1 (0.72) GAAALDH1A1LMNACYP1A2CYP2D6
SCHEMBL20164277 0.77 LMNA (0.58) GAAALDH1A1LMNACYP2D6SCN1A
SCHEMBL203843 0.77 CA12 (0.68) GAAALDH1A1LMNACYP1A2CYP3A4
SCHEMBL811573 0.77 GAA (0.72) GAAALDH1A1LMNACYP1A2CYP2D6
SCHEMBL6057260 0.76 ALDH1A1 (0.69) GAAALDH1A1LMNACYP1A2CYP2D6
SCHEMBL9481715 0.76 GAA (0.82) GAAALDH1A1LMNACYP1A2CYP2D6

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-3298048-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2019-07-03 EP disclosed
US-10221256-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-03-05 US disclosed
US-20180142044-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 US disclosed