SCHEMBL9459154

SCHEMBL9459154

[NH]N(C=O)N1CCOCC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL4696055 0.71 MAPT (0.35) CA12CA7CA14MAPT
SCHEMBL28223057 0.71 CA12 (0.32) CA12CA7CA14MAPT
SCHEMBL27613812 0.71 CA12 (0.33) CA12CA7CA14MAPT
SCHEMBL27810211 0.71 CA12 (0.32) CA12CA7CA14MAPT
SCHEMBL9646368 0.67
SCHEMBL272485 0.67 SMN1; SMN2 (0.37) MAPT
SCHEMBL2754289 0.66 MAPT (0.33) MAPT
SCHEMBL8506062 0.64
SCHEMBL28971983 0.64 MGLL (0.40) CA12CA7CA14MAPT
SCHEMBL28001517 0.64

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-5262400-A Antiparasitic and anthelmintic MERCK & CO., INC. (US) 1993-11-16 US disclosed
EP-0519731-A1 4a-Substituted avermectin derivatives MERCK & CO. INC. (US) 1992-12-23 EP disclosed