SCHEMBL5344126

SCHEMBL5344126

O=C1OC2(CCN(C(=O)N3CCCCC3)CC2)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.61
SIGMAR1 Q99720 1/20 0.54
NPY5R Q15761 13/20 0.54
HSD11B1 P28845 4/20 0.53
CYP2D6 P10635 1/20 0.53

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
SCHEMBL11839484 0.83 HRH3 (0.58) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL2001104 0.80 HRH3 (0.66) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL3860397 0.80 SIGMAR1 (0.60) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL11842983 0.80 NPY5R (0.56) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL5786578 0.79 NPY5R (0.55) HRH3NPY5R
SCHEMBL1995597 0.79 HRH3 (0.65) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL6427482 0.78 SIGMAR1 (0.56) HRH3SIGMAR1NPY5R
Hydrochloric Acid SCHEMBL4045751 0.78 SIGMAR1 (0.54) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL11840173 0.77 HRH3 (0.55) HRH3SIGMAR1NPY5RHSD11B1CYP2D6
SCHEMBL3952096 0.77 HRH3 (1.00) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070208001-A1 Modulators of 11- beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-09-06 US claimed
WO-2007103719-A2 MODULATORS OF 11-β HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-09-13 WO disclosed
WO-2007103719-A2 MODULATORS OF 11-β HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-09-13 WO disclosed
US-20070208001-A1 Modulators of 11- beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-09-06 US disclosed
US-20070208001-A1 Modulators of 11- beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-09-06 US disclosed
US-20070208001-A1 Modulators of 11- beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-09-06 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-20070208001-A1 Modulators of 11- beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same HSD11B1, HSD17B1, HSD3B1 HRH3 2984/4885SIGMAR1 1983/4885NPY5R 4004/4885

“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.