SCHEMBL9202983

SCHEMBL9202983

C=C(C(=O)OCC)C1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
HSD17B10 Q99714 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
UCHL1 P09936 1/20 0.42

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
SCHEMBL20002160 0.86 KMT2A (0.56) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL28953620 0.86 HSD17B10 (0.60) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL29935483 0.86 HSD17B10 (0.60) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL8223617 0.83 FKBP1A (0.58) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL1401256 0.83 FKBP1A (0.58) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL440340 0.83 FKBP1A (0.58) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL20626011 0.83 MEN1 (0.50) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL28916508 0.82 KMT2A (0.55) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL28581241 0.82 KMT2A (0.55) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL28915732 0.82 KMT2A (0.55) KMT2AMEN1HSD17B10SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210883-B1 Derivatives of penem DAIICHI SEIYAKU CO (JP) 1995-02-01 EP disclosed
US-5079357-A Bactericides DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1992-01-07 US disclosed
US-4962202-A PENICILLIN INTERMEDIATES DAIICHI SEIYAKU CO., LTD. (JP) 1990-10-09 US disclosed
EP-0210883-A2 Derivatives of penem DAIICHI SEIYAKU CO., LTD. (JP) 1987-02-04 EP disclosed