SCHEMBL5140914

SCHEMBL5140914

CC1(CC(C)(O)C(F)Nc2cccc3cnccc23)CCCc2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 13/20 0.68
KDM5A P29375 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
KDM5B Q9UGL1 1/20 0.44
LMNA P02545 1/20 0.39
TRPV1 Q8NER1 2/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KMT2A Q03164 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
SCHEMBL5140912 0.81 NR3C1 (0.78) NR3C1KDM5AKDM4CKDM5BLMNA
SCHEMBL809247 0.81 NR3C1 (1.00) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809173 0.77 NR3C1 (0.89) NR3C1KDM5AKDM4CKDM5BTRPV1
SCHEMBL809261 0.74 NR3C1 (0.63) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809262 0.74 NR3C1 (0.63) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809096 0.71 NR3C1 (1.00) NR3C1
SCHEMBL809160 0.68 NR3C1 (0.89) NR3C1KDM5AKDM4CKDM5BTRPV1
SCHEMBL11143217 0.64 LMNA (0.62) LMNATRPV1ALDH1A1MAPTKDM4E
SCHEMBL809048 0.64 NR3C1 (0.62) NR3C1
SCHEMBL809049 0.64 NR3C1 (0.62) NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2008509191-A 2008-03-27 JP claimed
EP-1776119-A1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2007-04-25 EP claimed
WO-2006015870-A1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2006-02-16 WO claimed
EP-1776119-A1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2007-04-25 EP disclosed
WO-2006015870-A1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2006-02-16 WO disclosed