SCHEMBL11034809

SCHEMBL11034809

CC/C=C\C/C=C\C/C=C\CCCCCCCCn1cc(F)c(=O)[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
TK1 P04183 1/20 0.47
KMT2A Q03164 3/20 0.44
MAPT P10636 3/20 0.44
CYP2C9 P11712 2/20 0.44
CYP1A2 P05177 4/20 0.43
CYP2C19 P33261 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 1/20 0.43
HIF1A Q16665 2/20 0.40
EPAS1 Q99814 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 2/20 0.39
MGLL Q99685 2/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
KDM4E B2RXH2 2/20 0.39
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39

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
SCHEMBL10928811 0.85 TK1 (0.44) LMNATK1KMT2AMAPTCYP1A2
SCHEMBL10752190 0.85 LMNA (0.56) LMNATK1KMT2AMAPTCYP1A2
SCHEMBL10504842 0.82 ALDH1A1 (0.54) LMNATK1KMT2AMAPTCYP1A2
SCHEMBL10504844 0.82 ALDH1A1 (0.54) LMNATK1KMT2AMAPTCYP1A2
SCHEMBL6760088 0.81 CYP1A2 (0.62) LMNATK1KMT2AMAPTCYP2C9
SCHEMBL17232952 0.80 LMNA (0.47) LMNATK1KMT2AMAPTCYP2C9
SCHEMBL10976239 0.79 CYP1A2 (0.60) LMNATK1KMT2AMAPTCYP2C9
SCHEMBL10506071 0.79 LMNA (0.54) LMNATK1KMT2AMAPTCYP1A2
SCHEMBL10506077 0.79 LMNA (0.54) LMNATK1KMT2AMAPTCYP1A2
SCHEMBL10754597 0.79 ALDH1A1 (0.45) LMNATK1KMT2AMAPTCYP1A2

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-59067275-A None JP disclosed
JP-S5967275-A 5-FLUOROURACIL DERIVATIVE AND ITS PREPARATION TERUMO CORP 1984-04-16 JP disclosed