SCHEMBL809173

SCHEMBL809173

[2H]OC(CNc1cccc2cnccc12)(CC1(C)CCCc2ccccc21)C(F)(F)F

nearest known ligand 0.89

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.89
KDM5A P29375 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
KDM5B Q9UGL1 1/20 0.45
TRPV1 Q8NER1 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL809247 0.94 NR3C1 (1.00) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809160 0.89 NR3C1 (0.89) NR3C1KDM5AKDM4CKDM5BTRPV1
SCHEMBL809055 0.84 NR3C1 (0.89) NR3C1KDM5AKDM4CKDM5B
SCHEMBL5140912 0.84 NR3C1 (0.78) NR3C1KDM5AKDM4CKDM5BTRPV1
SCHEMBL809105 0.83 NR3C1 (0.89) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809096 0.83 NR3C1 (1.00) NR3C1
SCHEMBL809123 0.78 NR3C1 (1.00) NR3C1KDM5AKDM4CKDM5B
SCHEMBL5140914 0.77 NR3C1 (0.68) NR3C1KDM5AKDM4CKDM5BTRPV1
SCHEMBL821013 0.77 NR3C1 (1.00) NR3C1
SCHEMBL808953 0.74 NR3C1 (0.89) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1776119-B9 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2012-06-13 EP claimed
EP-1776119-B1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2012-01-18 EP claimed
US-7902224-B2 Tetrahydro-naphthalene derivatives as glucocorticoid receptor modulators GLAXO GROUP LIMITED (GB) 2011-03-08 US claimed