SCHEMBL11753239

SCHEMBL11753239

[CH2]C(O)C(O)C(O)C(O)C(O)CO

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.71
LMNA P02545 2/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
KDM4E B2RXH2 2/20 0.44
PDE4A P27815 1/20 0.44
USP2 O75604 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
MGAM O43451 5/20 0.33
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TOP1 P11387 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
SCHEMBL3761094 1.00 TDP1 (0.71) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL6072946 1.00 TDP1 (0.71) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL3050298 0.97 LMNA (0.69) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL8348104 0.97 LMNA (0.69) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL1302931 0.97 LMNA (0.69) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL17101325 0.97 LMNA (0.69) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL219171 0.97 LMNA (0.69) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL865783 0.88
SCHEMBL148513 0.88
SCHEMBL17101240 0.88

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-4046893-A ANALGESIC, ANTIPHLOGISTIC NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JA) 1977-09-06 US disclosed
US-3946012-A 6-L-dihydroxyethyl-2,4,7-trioxo-8-D-ribityl pteridine and process for producing the same NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JA) 1976-03-23 US disclosed