SCHEMBL6664834

SCHEMBL6664834

CCC(C(CC(=O)OCO)N1CC1)(C(CC(=O)OCO)N1CC1)C(CC(=O)OCO)N1CC1.OCC(CO)(CO)CO

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL5068246 0.94 MAPT (0.33) MAPTMAPK1NPSR1L3MBTL1
SCHEMBL9234649 0.72 KDM4E (0.32)
SCHEMBL8073618 0.69
SCHEMBL2680213 0.67 PRKCA (0.32)
SCHEMBL935735 0.65
SCHEMBL11064826 0.63
SCHEMBL28317073 0.62 PRKCA (0.30)
SCHEMBL2121080 0.60 KDM4E (0.43) MAPTNPSR1L3MBTL1
SCHEMBL2218452 0.59 SLC6A9 (0.37) L3MBTL1
SCHEMBL2218448 0.59 SMN1; SMN2 (0.40) MAPK1

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
US-20040161542-A1 Aqueous composition and method of preparing nonyellowing coating therefrom ZIEMANN OTTO CARL (US) 2004-08-19 US disclosed
EP-1447432-A1 Aqueous composition and method of preparing nonyellowing coating therefrom ROHM AND HAAS COMPANY (US) 2004-08-18 EP disclosed