SCHEMBL7250246

SCHEMBL7250246

COC(=O)Cc1cc(Br)c(Oc2ccc(OC)c([N+](=O)[O-])c2)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 5/20 0.44
LMNA P02545 1/20 0.43
THRA P10827 6/20 0.42
THRB P10828 6/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL5858232 0.90 THRB (0.53) MEN1KMT2AMAPTPOLBTHRA
SCHEMBL27874611 0.87 ALDH1A1 (0.42) MEN1KMT2AMAPTPOLBALDH1A1
SCHEMBL7255051 0.81 THRB (0.48) POLBLMNATHRATHRBSMN1; SMN2
SCHEMBL7251517 0.81 THRB (0.45) MEN1KMT2AMAPTALDH1A1THRA
SCHEMBL7121678 0.81 MAPT (0.46) MEN1KMT2AMAPTPOLBALDH1A1
SCHEMBL5858762 0.80 THRB (0.55) THRATHRB
SCHEMBL5282266 0.80 THRA (0.47) THRATHRBCYP3A4
SCHEMBL5283826 0.80 THRB (0.60) THRATHRB
SCHEMBL5282025 0.79 THRB (0.52) ALDH1A1THRATHRBHTT
SCHEMBL6986744 0.79 ALDH1A1 (0.61) MEN1KMT2AMAPTALDH1A1LMNA

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
US-20030166725-A1 Compounds active at the glucocorticoid receptor KARO BIO AB (SE) 2003-09-04 US disclosed
EP-1265839-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR KARO BIO AB (SE) 2002-12-18 EP disclosed
WO-2001047859-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR KARO BIO AB (SE) 2001-07-05 WO 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-20030166725-A1 Compounds active at the glucocorticoid receptor NR3C1, NR3C2, GPR119 MEN1 2906/4885KMT2A 3982/4885MAPT 4442/4885

“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.