SCHEMBL3333350

SCHEMBL3333350

O=C(NC1C2CC3CC1CC(O)(C3)C2)c1ccc(Oc2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.48
EPHX2 P34913 3/20 0.46
HSD11B1 P28845 9/20 0.44
EZH2 Q15910 1/20 0.43
PNLIP P16233 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.41
FFAR1 O14842 2/20 0.40
HSD11B2 P80365 1/20 0.40

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
SCHEMBL3330768 0.88 EPHX2 (0.52) MAPK8EPHX2HSD11B1HSD11B2
SCHEMBL3328670 0.81 HSD11B1 (0.51) MAPK8EPHX2HSD11B1
SCHEMBL3329136 0.81 HSD11B1 (0.40) HSD11B1PNLIPMRGPRX4FFAR1
SCHEMBL3274695 0.76 HPGD (0.52) EPHX2
SCHEMBL13431297 0.75 MAPK8 (0.49) MAPK8EPHX2HSD11B1
SCHEMBL13431304 0.75 MAPK8 (0.51) MAPK8EPHX2HSD11B1
SCHEMBL13431298 0.75 MAPK8 (0.51) MAPK8EPHX2HSD11B1
SCHEMBL16530082 0.73 HSD11B1 (0.57) MAPK8EPHX2HSD11B1
SCHEMBL1675970 0.73 HSD11B1 (0.57) MAPK8EPHX2HSD11B1
SCHEMBL13383854 0.73 HSD11B1 (0.45) MAPK8HSD11B1HSD11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137377-A1 NOVEL COMPOUNDS SOREN EBDRUP ET AL 2010-06-03 US claimed
EP-2152081-A1 NOVEL COMPOUNDS High Point Pharmaceuticals, LLC (US) 2010-02-17 EP claimed
WO-2008127924-A1 NOVEL COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC. (US) 2008-10-23 WO claimed
EP-2152081-B1 NOVEL COMPOUNDS HIGH POINT PHARMACEUTICALS LLC (US) 2012-10-24 EP disclosed
EP-2152081-B1 NOVEL COMPOUNDS HIGH POINT PHARMACEUTICALS LLC (US) 2012-10-24 EP disclosed
US-20100137377-A1 NOVEL COMPOUNDS SOREN EBDRUP ET AL 2010-06-03 US disclosed
US-20100137377-A1 NOVEL COMPOUNDS SOREN EBDRUP ET AL 2010-06-03 US disclosed
US-20100137377-A1 NOVEL COMPOUNDS SOREN EBDRUP ET AL 2010-06-03 US disclosed
EP-2152081-A1 NOVEL COMPOUNDS High Point Pharmaceuticals, LLC (US) 2010-02-17 EP disclosed
WO-2008127924-A1 NOVEL COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC. (US) 2008-10-23 WO disclosed
WO-2008127924-A1 NOVEL COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC. (US) 2008-10-23 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-20100137377-A1 NOVEL COMPOUNDS HSD11B1, CYP11B1, HSD11B2 MAPK8 2760/4885EPHX2 2422/4885HSD11B1 1/4885

“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.