SCHEMBL8437982

SCHEMBL8437982

CC(C)c1cc(C(C)C)c(S(=O)(=O)NCCSC(=O)COc2ccccc2)c(C(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.41
F10 P00742 1/20 0.40
PLAU P00749 1/20 0.40
PLAT P00750 1/20 0.40
ENPP3 O14638 1/20 0.38
ENPP1 P22413 1/20 0.38
USP2 O75604 1/20 0.37
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL7919255 0.82 PSEN1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8438783 0.81 L3MBTL1 (0.52) NPC1GAAALDH1A1USP2HTT
SCHEMBL8437981 0.80 PLAU (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7920364 0.80 ALDH1A1 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8441006 0.79 ALDH1A1 (0.43) NPC1GAAALDH1A1USP2HTT
SCHEMBL8442526 0.78 TBXA2R (0.57) GAAALDH1A1HTTLMNAMAPK1
SCHEMBL8437798 0.77 ALDH1A1 (0.59) GAAALDH1A1LMNASMN1; SMN2NPY5R
SCHEMBL8437961 0.76 MEN1 (0.54) GAAALDH1A1USP2HTTLMNA
SCHEMBL8440903 0.75 ALDH1A1 (0.62) ALDH1A1HTTMAPK1SMN1; SMN2TBXA2R
SCHEMBL8437712 0.74 CA1 (0.45) NPC1RAB9AGAAALDH1A1USP2

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-5955505-A TREATING NERVE DEGENERATIVE DISORDERS NIPPON SUISAN KAISHA, LTD. (JP) 1999-09-21 US disclosed