SCHEMBL29859488

SCHEMBL29859488

Cc1cc(S(=O)(=O)N2CC(F)(F)C2)ccc1Br

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
LMNA P02545 4/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ABL1 P00519 1/20 0.48
RIN1 Q13671 1/20 0.48
PKM P14618 1/20 0.45
TSHR P16473 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.40
HTT P42858 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
MAPK1 P28482 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
SCHEMBL19989416 1.00 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL19989141 0.89 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL29859307 0.89 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL19989429 0.86 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL29859296 0.86 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL19989512 0.85 ALDH1A1 (0.52) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL29859243 0.85 ALDH1A1 (0.52) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL19989545 0.84 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL29859591 0.84 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL19994863 0.82 ABL1 (0.46) ALDH1A1MEN1KMT2ALMNAL3MBTL1

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
CN-109715608-B Indazole compounds for use in tendon and/or ligament injuries 诺华股份有限公司 2022-08-05 CN disclosed