SCHEMBL4637080

SCHEMBL4637080

CS(=O)(=O)SCCC(=O)OCn1cc(F)c(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA3 P42263 1/20 0.41
GRIA4 P48058 1/20 0.41
GRIK5 Q16478 1/20 0.41
KMT2A Q03164 2/20 0.40
CA12 O43570 13/20 0.39
CA9 Q16790 13/20 0.39
CA1 P00915 11/20 0.39
CA2 P00918 11/20 0.39
POLB P06746 1/20 0.35

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
SCHEMBL5479694 0.81 LMNA (0.67) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11399951 0.79 LMNA (0.64) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL15760447 0.78 LMNA (0.59) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL14340500 0.78 LMNA (0.60) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11396051 0.78 LMNA (0.62) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11397642 0.78 LMNA (0.62) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11393256 0.77 LMNA (0.61) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL18798671 0.77 LMNA (0.57) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11397990 0.77 LMNA (0.61) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11400022 0.77 LMNA (0.61) LMNAKDM4ECYP1A2GRIA1GRIA2

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
EP-1939186-A1 5-Fluorouracil derivatives and their use for the treatment of cancer Sulfidris S.r.l. (IT) 2008-07-02 EP claimed
EP-1939186-A1 5-Fluorouracil derivatives and their use for the treatment of cancer Sulfidris S.r.l. (IT) 2008-07-02 EP disclosed