SCHEMBL21362335

SCHEMBL21362335

C=CNC1CCCN(C)C1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 12/20 0.37
BPTF Q12830 1/20 0.37
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
EHMT2 Q96KQ7 2/20 0.31
IL1B P01584 2/20 0.31
NLRP3 Q96P20 2/20 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
SCHEMBL20902637 0.92 KAT2B (0.39) KAT2BBPTFKDM4EALDH1A1
SCHEMBL3939409 0.80 ADH1B (0.52) KAT2BBPTF
SCHEMBL11896733 0.78
SCHEMBL1934606 0.77
SCHEMBL13797755 0.74 POLB (0.37) KAT2B
SCHEMBL1914090 0.74
SCHEMBL1914093 0.74
SCHEMBL7219700 0.74
SCHEMBL19826021 0.73 BTK (0.42) KDM4EALDH1A1
SCHEMBL16791394 0.73 BTK (0.42) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857401-B1 NOVEL -LACTAMASE INHIBITOR AND METHOD FOR PRODUCING SAME MEIJI SEIKA PHARMA CO LTD (JP) 2019-09-18 EP disclosed