SCHEMBL26066089

SCHEMBL26066089

O=S(=O)(c1ccc(C(F)(F)F)nc1Cl)N1CCN(C2CCOCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NAMPT P43490 4/20 0.40
TRPV4 Q9HBA0 1/20 0.39
DDR1 Q08345 3/20 0.39
HPGD P15428 1/20 0.38
USP5 P45974 1/20 0.38

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
SCHEMBL26065535 0.88 MEN1 (0.42) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL25368228 0.87 ALDH1A1 (0.36) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26064898 0.87 MEN1 (0.43) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26066093 0.86 MEN1 (0.41) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26066126 0.84 MEN1 (0.39) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26066128 0.84 MEN1 (0.41) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL26065512 0.82 DDR1 (0.40) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26065806 0.81 MEN1 (0.39) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26065408 0.80 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL26065451 0.80 KMT2A (0.46) ALDH1A1KMT2AMEN1MAPK1KDM4E

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-2023164063-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-08-31 WO disclosed