SCHEMBL12271925

SCHEMBL12271925

O=C1CC[C@]2(Cc3ccccc3)c3ccc(C(=O)O)cc3CCC[C@@H]2C1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 13/20 0.67
AR P10275 3/20 0.67
KDM1A O60341 2/20 0.48
IL6 P05231 7/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
GRM1 Q13255 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
CFTR P13569 1/20 0.38
CYP3A4 P08684 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
SCHEMBL12272362 1.00 NR3C1 (0.67) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL12272067 1.00 NR3C1 (0.67) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL12272191 1.00 NR3C1 (0.67) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL13494367 0.94 NR3C1 (0.77) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL16252266 0.94 NR3C1 (0.77) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL12271690 0.94 NR3C1 (0.77) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL1571729 0.94 NR3C1 (0.77) NR3C1ARKDM1AIL6ALDH1A1
SCHEMBL12271720 0.89 NR3C1 (0.62) NR3C1ARKDM1AIL6MEN1
SCHEMBL12271823 0.89 NR3C1 (0.62) NR3C1ARKDM1AIL6MEN1
SCHEMBL12272688 0.89 NR3C1 (0.62) NR3C1ARKDM1AIL6MEN1

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-20120238549-A1 Nuclear Hormone Receptor Modulators ABBOTT LABORATORIES (US) 2012-09-20 US claimed
US-20120238549-A1 Nuclear Hormone Receptor Modulators ABBOTT LABORATORIES (US) 2012-09-20 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-20120238549-A1 Nuclear Hormone Receptor Modulators NR5A1, NR5A2, NR3C2 NR3C1 7/4885AR 14/4885KDM1A 3323/4885

“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.