SCHEMBL9340830

SCHEMBL9340830

O=CCNC(=O)C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA3 P07451 2/20 0.56
CA5A P35218 2/20 0.56
CA5B Q9Y2D0 2/20 0.56
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
POLB P06746 1/20 0.52
CA2 P00918 2/20 0.50
CA14 Q9ULX7 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CA12 O43570 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
EPHX1 P07099 1/20 0.42
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 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
SCHEMBL18262004 0.82 ALDH1A1 (0.54) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL18262005 0.82 ALDH1A1 (0.54) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL13861685 0.78 ALDH1A1 (0.79) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL236402 0.78 ALDH1A1 (0.50) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL6263928 0.78 ALDH1A1 (0.50) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL8615387 0.78 ALDH1A1 (0.50) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL1252712 0.77 CA3 (0.86) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL10231803 0.77 CA3 (0.86) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL989637 0.76 CA3 (0.63) CA3CA5ACA5BALDH1A1SMN1; SMN2
SCHEMBL13967019 0.75 L3MBTL1 (0.39) CA3CA5ACA5BALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0270651-B1 NOVEL DEOXYRIBONUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE FOR THE PREPARATION OF OLIGONUCLEOTIDES CALIFORNIA INST OF TECHN (US) 1994-06-15 EP claimed
US-4849513-A Deoxyribonucleoside phosphoramidites in which an aliphatic amino group is attached to the sugar ring and their use for the preparation of oligonucleotides containing aliphatic amino groups CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1989-07-18 US claimed
EP-0270651-A4 NOVEL DEOXYRIBONUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE FOR THE PREPARATION OF OLIGONUCLEOTIDES. CALIFORNIA INST OF TECHN (US) 1989-03-29 EP claimed
EP-0270651-A1 NOVEL DEOXYRIBONUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE FOR THE PREPARATION OF OLIGONUCLEOTIDES. CALIFORNIA INST OF TECHN (US) 1988-06-15 EP claimed
WO-1988000201-A1 NOVEL DEOXYRIBONUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE FOR THE PREPARATION OF OLIGONUCLEOTIDES CALIFORNIA INSTITUTE OF TECHNOLOGY, INC. (US) 1988-01-14 WO claimed
WO-2023014360-A1 TREATMENT AND DIAGNOSIS OF IMMUNE DISORDERS RELATING TO ABERRANT IMMUNE CELLS OCTAGON THERAPEUTICS, INC. (US) 2023-02-09 WO disclosed
EP-0270651-B1 NOVEL DEOXYRIBONUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE FOR THE PREPARATION OF OLIGONUCLEOTIDES CALIFORNIA INST OF TECHN (US) 1994-06-15 EP disclosed
EP-0556585-A2 Condensed camptothecin derivatives their production and use as antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-08-25 EP disclosed