SCHEMBL3014149

SCHEMBL3014149

CC(C)(C)[C@H](N)CNC1C2CC3CC(C2)CC1C3

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
EPHX1 P07099 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
HSD11B1 P28845 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL13207454 0.79 TDP1 (0.40) EPHX2TDP1EPHX1SMN1; SMN2LMNA
SCHEMBL3008613 0.76 HSD11B1 (0.36) EPHX2TDP1EPHX1SMN1; SMN2LMNA
SCHEMBL15022007 0.76 EPHX2 (0.49) EPHX2TDP1SMN1; SMN2LMNAHSD11B1
SCHEMBL24927361 0.70 EPHX1 (0.43) EPHX2TDP1EPHX1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL28651729 0.69 EPHX2 (0.38) EPHX2TDP1SMN1; SMN2LMNAALDH1A1
SCHEMBL6686034 0.66 L3MBTL1 (0.45) EPHX2TDP1SMN1; SMN2LMNAALDH1A1
SCHEMBL1778693 0.65 SMN1; SMN2 (0.61) EPHX2TDP1SMN1; SMN2LMNAALDH1A1
SCHEMBL9974906 0.65 SMN1; SMN2 (0.45) EPHX2TDP1SMN1; SMN2LMNAHSD11B1
SCHEMBL12344538 0.63 LMNA (0.48) EPHX2TDP1SMN1; SMN2LMNAALDH1A1
SCHEMBL14573044 0.63 EPHX2 (0.53) EPHX2TDP1SMN1; SMN2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835426-B2 Cyclic urea and carbamate inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2014-09-16 US disclosed
US-20100197675-A1 CYCLIC UREA AND CARBAMATE INHIBITORS OF 11 BETA-HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. 2010-08-05 US disclosed
EP-2125750-A2 CYCLIC UREA AND CARBAMATE INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE 1 Vitae Pharmaceuticals, Inc. (US) 2009-12-02 EP disclosed
WO-2008106128-A2 CYCLIC UREA AND CARBAMATE INHIBITORS OF 11β -HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. (US) 2008-09-04 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-20100197675-A1 CYCLIC UREA AND CARBAMATE INHIBITORS OF 11 BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD3B1, HSD11B2 EPHX2 1527/4885TDP1 863/4885EPHX1 999/4885

“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.