SCHEMBL3334012

SCHEMBL3334012

O=C(NC1C2CC3CC1CC(CO)(C3)C2)c1ccc(Oc2ccc(Cl)cn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 17/20 0.54
HSD11B2 P80365 7/20 0.54
NPC1 O15118 2/20 0.41
CASP3 P42574 2/20 0.41
RAB9A P51151 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LIPE Q05469 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL3328670 0.87 HSD11B1 (0.51) HSD11B1NPC1CASP3RAB9ASENP8
SCHEMBL13474010 0.86 HSD11B1 (0.41) HSD11B1HSD11B2NPC1CASP3RAB9A
SCHEMBL1168572 0.77 HSD11B1 (0.48) HSD11B1
SCHEMBL13320278 0.76 HSD11B1 (0.46) HSD11B1
SCHEMBL4556735 0.74 P2RX7 (0.55) HSD11B1HSD11B2KMT2A
SCHEMBL3330768 0.74 EPHX2 (0.52) HSD11B1HSD11B2
SCHEMBL3328689 0.74 HSD11B1 (0.54) HSD11B1
SCHEMBL14047188 0.73 POLB (0.39) HSD11B1NPC1CASP3RAB9ASENP8
SCHEMBL6303431 0.73 NPC1 (0.43) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL3773962 0.72 NPC1 (0.54) HSD11B1HSD11B2NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2152081-B1 NOVEL COMPOUNDS HIGH POINT PHARMACEUTICALS LLC (US) 2012-10-24 EP claimed
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
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

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 HSD11B1 1/4885HSD11B2 3/4885NPC1 143/4885

“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.