SCHEMBL3284203

SCHEMBL3284203

C/C=C/C[C@@]12CCC(=O)C=C1CCc1cc(OC)ccc12

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.65
NR3C1 P04150 1/20 0.45
METAP1 P53582 2/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
KDM1A O60341 1/20 0.38
BACE1 P56817 1/20 0.36
CYP2C19 P33261 1/20 0.36
ADRA2A P08913 1/20 0.36
MAOB P27338 1/20 0.36
PARP1 P09874 1/20 0.35
DRD2 P14416 3/20 0.35
DRD1 P21728 3/20 0.35
DRD5 P21918 3/20 0.35
DRD3 P35462 3/20 0.35
DRD4 P21917 1/20 0.34

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
SCHEMBL3910326 0.87 AR (0.67) ARNR3C1METAP1ALDH1A1LMNA
SCHEMBL3910141 0.84 AR (0.72) ARNR3C1METAP1ALDH1A1LMNA
SCHEMBL6565555 0.82 AR (0.69) ARNR3C1METAP1ALDH1A1LMNA
SCHEMBL6249986 0.80 AR (0.67) ARNR3C1ALDH1A1LMNACYP3A4
SCHEMBL3284563 0.79 AR (1.00) ARNR3C1BACE1MAOB
SCHEMBL3288674 0.79 AR (1.00) ARNR3C1BACE1MAOB
SCHEMBL3285403 0.77 AR (0.50) ARNR3C1ALDH1A1LMNACYP2C19
SCHEMBL12272588 0.77 AR (0.63) ARNR3C1ALDH1A1LMNAKDM1A
SCHEMBL12272913 0.77 AR (0.63) ARNR3C1ALDH1A1LMNAKDM1A
SCHEMBL12273326 0.77 AR (0.63) ARNR3C1ALDH1A1LMNAKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713989-B2 Glucocorticoid receptor modulators DOW ROBERT L 2010-05-11 US disclosed
US-20070117805-A1 Glucocorticoid receptor modulators PFIZER INC. 2007-05-24 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-20070117805-A1 Glucocorticoid receptor modulators NR3C1, NR3C2, MC2R AR 84/4885NR3C1 1/4885METAP1 2227/4885

“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.