SCHEMBL3965388

SCHEMBL3965388

CCOCc1c(N(Cc2ccccc2)Cc2ccccc2)cccc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 5/20 0.58
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 5/20 0.40
LMNA P02545 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 1/20 0.38
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37

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
SCHEMBL3962657 0.87 KMT2A (0.44) NR3C1KMT2AMEN1CYP1A2CYP2D6
SCHEMBL3967226 0.80 NR3C1 (0.52) NR3C1KMT2AMEN1CYP1A2CYP2D6
SCHEMBL3960771 0.77 KMT2A (0.53) NR3C1KMT2AMEN1CYP1A2CYP2D6
SCHEMBL27930925 0.76 MEN1 (0.50) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL3969322 0.74 KMT2A (0.48) NR3C1KMT2AMEN1CYP1A2CYP2C19
SCHEMBL18184995 0.74 TDP1 (0.47) KMT2AMEN1ALDH1A1LMNA
SCHEMBL18184993 0.74 TSHR (0.51) KMT2AMEN1ALDH1A1LMNAL3MBTL1
SCHEMBL3962558 0.74 KMT2A (0.46) NR3C1KMT2AMEN1CYP1A2CYP2D6
SCHEMBL3966943 0.73 KMT2A (0.50) NR3C1KMT2AMEN1CYP1A2CYP2C19
SCHEMBL3966492 0.73 NR3C1 (1.00) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363876-B1 GLUCOCORTICOID RECEPTOR MODULATORS KAROBIO AB (SE) 2009-07-29 EP disclosed
EP-1363876-A1 GLUCOCORTICOID RECEPTOR MODULATORS Abbott Laboratories (US) 2003-11-26 EP disclosed
US-6583180-B2 Antidiabetic agents ABBOTT LABORATORIES 2003-06-24 US disclosed
US-20020156311-A1 Glucocorticoid receptor modulators KARO BIO AB (SE) 2002-10-24 US disclosed
WO-2002064550-A1 GLUCOCORTICOID RECEPTOR MODULATORS ABBOTT LABORATORIES (US) 2002-08-22 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-20020156311-A1 Glucocorticoid receptor modulators NR3C1, NR5A1, NR3C2 NR3C1 1/4885KMT2A 4447/4885MEN1 2380/4885

“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.