SCHEMBL808958

SCHEMBL808958

CC1(CC(O)(C=Nc2cccc3ncccc23)C(F)(F)F)CCCc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.61
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM5A P29375 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM5B Q9UGL1 1/20 0.35

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
SCHEMBL808959 1.00 NR3C1 (0.61) NR3C1KDM4EMAPTALOX15MAPK1
SCHEMBL809000 0.87 NR3C1 (0.62) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809001 0.87 NR3C1 (0.62) NR3C1KDM5AKDM4CKDM5B
SCHEMBL808999 0.87 NR3C1 (0.62) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809261 0.84 NR3C1 (0.63) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809262 0.84 NR3C1 (0.63) NR3C1KDM5AKDM4CKDM5B
SCHEMBL27700376 0.83 NR3C1 (0.42) NR3C1KDM4EMAPTALOX15MAPK1
SCHEMBL809123 0.76 NR3C1 (1.00) NR3C1KDM5AKDM4CKDM5B
SCHEMBL809048 0.74 NR3C1 (0.62) NR3C1
SCHEMBL809049 0.74 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 4 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 disclosed
EP-1776119-B1 TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2012-01-18 EP disclosed
US-7902224-B2 Tetrahydro-naphthalene derivatives as glucocorticoid receptor modulators GLAXO GROUP LIMITED (GB) 2011-03-08 US disclosed
US-20070224130-A1 Tetrahydro-Naphthalene Derivatives as Glucocorticoid Receptor Modulators GLAXO GROUP LIMITED (GB) 2007-09-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070224130-A1 Tetrahydro-Naphthalene Derivatives as Glucocorticoid Receptor Modulators NR3C1, NR3C2, MC2R NR3C1 1/4885KDM4E 997/4885MAPT 3910/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.