SCHEMBL1604936

SCHEMBL1604936

C[C@@]1(CC(F)(F)F)SC(N[C@H]2C[C@H]3CC[C@H]2C3)=NC1=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 12/20 0.35
HPGD P15428 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
GABBR2 O75899 3/20 0.33
GABBR1 Q9UBS5 3/20 0.33
CNR2 P34972 2/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
CNR1 P21554 1/20 0.32

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
SCHEMBL1605037 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL1605035 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL13998655 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL13121912 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL13998635 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL1604934 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL1606466 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL1606464 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL14429828 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2
SCHEMBL1604938 1.00 BRS3 (0.35) BRS3HPGDPDE3BPDE3AGABBR2

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-8541592-B2 Inhibitors of 11-beta-hydroxysteroid dehydrogenase type 1 AMGEN INC. (US) 2013-09-24 US disclosed
US-20120010256-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB 2012-01-12 US disclosed
US-20110082107-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC. 2011-04-07 US disclosed
EP-1753736-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC (US) 2008-12-17 EP disclosed
US-20070281938-A1 Inhibitors of 11-Beta-Hydroxy Steroid Dehydrogenase Type 1 AMGEN INC. 2007-12-06 US disclosed
US-20070197598-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AMGEN INC. 2007-08-23 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 (4 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-20110082107-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD3B1, HSD17B1 BRS3 2744/4885HPGD 84/4885PDE3B 766/4885
US-20070197598-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD11B2 BRS3 3971/4885HPGD 43/4885PDE3B 1231/4885
US-20120010256-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD3B1, HSD17B1 BRS3 2744/4885HPGD 84/4885PDE3B 766/4885
US-20070281938-A1 Inhibitors of 11-Beta-Hydroxy Steroid Dehydrogenase Type 1 HSD11B1, HSD3B1, HSD17B1 BRS3 2763/4885HPGD 81/4885PDE3B 650/4885

“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.