SCHEMBL8546211

SCHEMBL8546211

CCC(Nn1ccc2cc(O)ccc21)c1ccncc1F

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
CYP17A1 P05093 1/20 0.34
RPS6KA3 P51812 1/20 0.33
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PPARG P37231 2/20 0.30
SLC6A2 P23975 1/20 0.30
BCHE P06276 1/20 0.30
ACHE P22303 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
Hydrochloric Acid SCHEMBL9674029 0.99 MAPT (0.34) MAPTCYP17A1RPS6KA3CYP11B1CYP11B2
SCHEMBL7616004 0.82 BCHE (0.44) CYP17A1RPS6KA3SLC6A2BCHEACHE
SCHEMBL8539328 0.81 BCHE (0.51) MAPTCYP11B1CYP11B2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL8544423 0.80 ROCK1 (0.42) MEN1KMT2ASMN1; SMN2
SCHEMBL9738851 0.78 BCHE (0.50) BCHEACHE
Hydrochloric Acid SCHEMBL9671998 0.77 BCHE (0.49) BCHEACHE
SCHEMBL9738706 0.76 BCHE (0.47) BCHE
Hydrochloric Acid SCHEMBL9671926 0.76 BCHE (0.46) BCHE
SCHEMBL8540339 0.75 BCHE (0.42) MAPTRPS6KA3SLC6A2BCHEACHE
SCHEMBL8546208 0.71 MAPT (0.36) MAPTSLC6A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468401-B1 1-(Substituted pyridinylamino)-1H-indol-5-yl substituted carbamates, a process for their preparation and their use as medicaments HOECHST MARION ROUSSEL INC (US) 1998-09-16 EP disclosed
US-5102891-A Useful for treating various memory dysfunctions such as alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1992-04-07 US disclosed
EP-0468401-A2 1-(Substituted pyridinylamino)-1H-indol-5-yl substituted carbamates, a process and intermediates for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-01-29 EP disclosed