SCHEMBL1222483

SCHEMBL1222483

COC(=O)CC1CC2(CCNCC2)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.43
HSD11B2 P80365 1/20 0.43
EGFR P00533 1/20 0.42
SIGMAR1 Q99720 2/20 0.38
OPRM1 P35372 2/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CACNA1G O43497 3/20 0.34
CYP3A4 P08684 1/20 0.34
LPAR1 Q92633 1/20 0.34
MCHR2 Q969V1 2/20 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
SCHEMBL9391014 0.88 OPRM1 (0.44) HSD11B1HSD11B2SIGMAR1OPRM1HTT
SCHEMBL1949034 0.87 HSD11B1 (0.48) HSD11B1HSD11B2EGFRCYP3A4LPAR1
SCHEMBL1952794 0.86 HSD11B1 (0.37) HSD11B1HSD11B2EGFRCYP3A4MCHR2
SCHEMBL1952893 0.84 HSD11B1 (0.48) HSD11B1HSD11B2EGFRCYP3A4LPAR1
SCHEMBL4235542 0.84 HSD11B1 (0.55) HSD11B1HSD11B2EGFROPRM1
SCHEMBL1222515 0.84 HSD11B1 (0.55) HSD11B1HSD11B2EGFROPRM1
SCHEMBL1952157 0.82 HSD11B1 (0.46) HSD11B1EGFROPRM1HSD17B10CYP3A4
SCHEMBL1223765 0.82 HSD11B1 (0.56) HSD11B1HSD11B2EGFRCACNA1G
SCHEMBL4977677 0.80 HSD11B1 (0.38) HSD11B1HSD11B2SIGMAR1OPRM1
SCHEMBL14272835 0.78 SIGMAR1 (0.40) HSD11B1SIGMAR1OPRM1HSD17B10CYP3A4

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-8927715-B2 Inhibitors of 11β-hydroxysteroid dehydrogenase type 1 VITAE PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
US-8927715-B2 Inhibitors of 11β-hydroxysteroid dehydrogenase type 1 VITAE PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
US-8927715-B2 Inhibitors of 11β-hydroxysteroid dehydrogenase type 1 VITAE PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
US-20110034455-A1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. 2011-02-10 US disclosed
US-20110034455-A1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. 2011-02-10 US disclosed
US-20110034455-A1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. 2011-02-10 US disclosed
US-20100298368-A1 ANTAGONISTS OF PGD2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-11-25 US disclosed
EP-2064187-A2 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Vitae Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
WO-2009061681-A2 ANTAGONISTS OF PGD2 RECEPTORS AMIRA PHARMACEUTICALS, INC (US) 2009-05-14 WO disclosed
WO-2008024497-A2 INHIBITORS OF 11β -HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. (US) 2008-02-28 WO disclosed
WO-2008024497-A2 INHIBITORS OF 11β -HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. (US) 2008-02-28 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 (2 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-20110034455-A1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885HSD11B2 3/4885EGFR 4865/4885
US-20100298368-A1 ANTAGONISTS OF PGD2 RECEPTORS PTGDR2, PTGDR, LTB4R2 HSD11B1 442/4885HSD11B2 264/4885EGFR 3718/4885

“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.