SCHEMBL4098033

SCHEMBL4098033

N#Cc1ccc(N2CCCCN2Cc2cccnc2)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 7/20 0.49
CHRNB2 P17787 1/20 0.45
CHRNA4 P43681 1/20 0.45
APP P05067 2/20 0.40
SNCA P37840 2/20 0.40
MAPK10 P53779 1/20 0.39
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP19A1 P11511 1/20 0.38
CASP1 P29466 2/20 0.38
CASP4 P49662 1/20 0.38
CASP5 P51878 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL4092323 0.99 AR (0.48) ARCHRNB2CHRNA4APPSNCA
SCHEMBL4101220 0.87 AR (0.57) ARTDP1
SCHEMBL4098544 0.86 AR (0.51) ARCYP19A1
SCHEMBL4102693 0.86 AR (0.56) ARTDP1
SCHEMBL4103881 0.85 AR (0.47) ARCYP19A1
SCHEMBL4103731 0.85 AR (0.54) ARTDP1
SCHEMBL4091065 0.84 AR (0.46) ARCYP19A1
SCHEMBL4103418 0.83 AR (0.47) AR
SCHEMBL4109015 0.82 AR (0.46) ARCYP19A1
SCHEMBL4098185 0.81 AR (0.53) AR

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
US-20090093464-A1 Naphthalene Derivatives as Modulators of the Glucocorticoid Receptor SMITHKLINE BEECHMA CORPORATION (US) 2009-04-09 US claimed
US-20090093464-A1 Naphthalene Derivatives as Modulators of the Glucocorticoid Receptor SMITHKLINE BEECHMA CORPORATION (US) 2009-04-09 US disclosed
US-20090093464-A1 Naphthalene Derivatives as Modulators of the Glucocorticoid Receptor SMITHKLINE BEECHMA CORPORATION (US) 2009-04-09 US disclosed
US-20090093464-A1 Naphthalene Derivatives as Modulators of the Glucocorticoid Receptor SMITHKLINE BEECHMA CORPORATION (US) 2009-04-09 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-20090093464-A1 Naphthalene Derivatives as Modulators of the Glucocorticoid Receptor NR3C1, NR3C2, NR5A1 AR 38/4885CHRNB2 631/4885CHRNA4 727/4885

“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.