SCHEMBL1750496

SCHEMBL1750496

CC(C)(C)[Si](OC1CCC2(CC1)CCN(Cc1c(Cl)cc(-c3ccc(C(=O)O)cc3)cc1Cl)C2=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.40
EGLN1 Q9GZT9 2/20 0.36
SSTR5 P35346 6/20 0.35
ESR1 P03372 2/20 0.34
HDAC11 Q96DB2 1/20 0.34
RIPK1 Q13546 3/20 0.33
RARG P13631 1/20 0.33
PDK2 Q15119 1/20 0.32
RORC P51449 1/20 0.32
S1PR5 Q9H228 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
SCHEMBL1752202 0.93 BACE1 (0.39) BACE1HDAC11RIPK1
SCHEMBL1750080 0.90 BACE1 (0.41) BACE1EGLN1HDAC11RIPK1
SCHEMBL1751913 0.88 RIPK1 (0.39) BACE1RIPK1RORC
SCHEMBL1750366 0.87 BACE1 (0.40) BACE1HDAC11RIPK1S1PR5
SCHEMBL2300871 0.83 ESR1 (0.34) BACE1SSTR5ESR1RORC
SCHEMBL12386298 0.83 TNKS (0.38) BACE1ESR1
SCHEMBL1750955 0.83 BACE1 (0.38) BACE1S1PR5
SCHEMBL1750766 0.81 BACE1 (0.37) BACE1HDAC11RIPK1
SCHEMBL1750321 0.78 PDE5A (0.47) EGLN1SSTR5HDAC11RIPK1
SCHEMBL2301573 0.77 CHRM4 (0.37) BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968585-B2 Inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2011-06-28 US disclosed
EP-2035379-B1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2010-06-16 EP disclosed
US-20090099180-A1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-04-16 US disclosed
EP-2035379-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 Eli Lilly & Company (US) 2009-03-18 EP disclosed
WO-2007127763-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 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-20090099180-A1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD11B2, HSD3B1 BACE1 155/4885EGLN1 546/4885SSTR5 1120/4885

“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.