SCHEMBL14608595

SCHEMBL14608595

CC/C(=C(/CC)c1ccc(OP(=O)(O)O)cc1)c1ccc(CO)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.81
NR1I2 O75469 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
ESR1 P03372 3/20 0.46
KMT2A Q03164 2/20 0.46
HIF1A Q16665 2/20 0.46
RECQL P46063 1/20 0.46
CYP2C19 P33261 2/20 0.45
STS P08842 1/20 0.44
SRC P12931 1/20 0.42
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ESR2 Q92731 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
NR3C1 P04150 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 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
Diethylstilbestrol Diphosphate SCHEMBL6231203 0.90 BLM (1.00) BLMNR1I2SMN1; SMN2ESR1KMT2A
Diethylstilbestrol Diphosphate SCHEMBL9370 0.90 BLM (1.00) BLMNR1I2SMN1; SMN2ESR1KMT2A
Diethylstilbestrol Diphosphate SCHEMBL809597 0.89 BLM (0.96) BLMNR1I2SMN1; SMN2ESR1KMT2A
Diethylstilbestrol Diphosphate SCHEMBL2496868 0.89 BLM (0.96) BLMNR1I2SMN1; SMN2ESR1KMT2A
Diethylstilbestrol Diphosphate SCHEMBL3664191 0.87 BLM (0.93) BLMNR1I2SMN1; SMN2ESR1KMT2A
SCHEMBL4957575 0.85 SRC (0.56) BLMSMN1; SMN2KMT2ACYP2C19SRC
Diethylstilbestrol Diphosphate SCHEMBL7617243 0.84 BLM (0.87) BLMNR1I2SMN1; SMN2ESR1KMT2A
SCHEMBL707840 0.84 BLM (0.87) BLMNR1I2SMN1; SMN2ESR1KMT2A
SCHEMBL707841 0.84 BLM (0.87) BLMNR1I2SMN1; SMN2ESR1KMT2A
Diethylstilbestrol Diphosphate SCHEMBL5488347 0.78 BLM (0.74) BLMNR1I2SMN1; SMN2ESR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1754712-A2 Transcobalamin binding conjugates useful for treating abnormal cellular proliferation MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2007-02-21 EP disclosed