SCHEMBL25787455

SCHEMBL25787455

C[N+]1(CCS(=O)(=O)NCC(F)(F)F)CCCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.33
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.30
KMT2A Q03164 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
SCHEMBL25787158 0.83
SCHEMBL25787456 0.81 BBOX1 (0.35) BBOX1KDM4ELMNAKMT2A
SCHEMBL25787512 0.81
SCHEMBL25787516 0.80
SCHEMBL25787383 0.70
SCHEMBL28254281 0.67 EPHX1 (0.34) KMT2A
Trifluoromethanesulfonamide SCHEMBL3434700 0.67 CA1 (0.41) BBOX1KDM4E
SCHEMBL15465474 0.66 LMNA (0.33) LMNA
SCHEMBL25787452 0.66 APOBEC3A (0.37) BBOX1KDM4ELMNAKMT2A
Trifluoromethanesulfonamide SCHEMBL28887116 0.66 CA1 (0.39) BBOX1KDM4ELMNAKMT2A

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
US-20230216086-A1 ELECTROLYTES FOR TARGET ION TRANSPORT MONASH UNIVERSITY (AU) 2023-07-06 US disclosed