SCHEMBL9617893

SCHEMBL9617893

COCC1=C(C(=O)O)N2C(=O)[C@@H]([C@H](C)O)[C@H]2S1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PTGS1 P23219 1/20 0.50
ELANE P08246 10/20 0.47
KDM4E B2RXH2 2/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL9353469 1.00 MEN1 (0.50) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL9349269 1.00 MEN1 (0.50) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL10426591 1.00 MEN1 (0.50) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL9349167 0.99 MEN1 (0.49) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL11012877 0.87 ELANE (0.48) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL10985736 0.87 ELANE (0.48) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL22844651 0.87 ELANE (0.48) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL11012879 0.87 ELANE (0.48) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL10670606 0.87 ELANE (0.48) MEN1KMT2APTGS1ELANEKDM4E
SCHEMBL29490922 0.87 ELANE (0.48) MEN1KMT2APTGS1ELANEKDM4E

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
JP-4069387-A None JP disclosed
JP-H0469387-A PENEM DERIVATIVE AND ITS PRODUCTION SUNTORY LTD 1992-03-04 JP disclosed