SCHEMBL26112604

SCHEMBL26112604

Bc1ncc(COCCOCC)s1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
DPP4 P27487 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL26111413 0.76
SCHEMBL26522338 0.69 L3MBTL1 (0.39) TDP1L3MBTL1MEN1KMT2ADPP4
SCHEMBL30598376 0.68 RAB9A (0.39) TDP1SMN1; SMN2
SCHEMBL26112607 0.67 RAB9A (0.38) TDP1SMN1; SMN2
SCHEMBL26114042 0.65
SCHEMBL22870282 0.64 DPP4 (0.41) TDP1L3MBTL1MEN1KMT2ADPP4
SCHEMBL5837395 0.63 SMN1; SMN2 (0.51) TDP1L3MBTL1SMN1; SMN2
SCHEMBL2899285 0.62 MEN1 (0.33) MEN1KMT2A
SCHEMBL22624008 0.62
SCHEMBL20391368 0.61 DPP4 (0.49) DPP4

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
WO-2023187012-A1 COMPOSITIONS INCLUDING AQUEOUS AMINE BORANE COMPLEXES AND POLYNUCLEOTIDES, AND METHODS OF USING THE SAME TO DETECT METHYLCYTOSINE OR HYDROXYMETHYLCYTOSINE ILLUMINA CAMBRIDGE LIMITED (GB) 2023-10-05 WO disclosed