SCHEMBL4469890

SCHEMBL4469890

Cc1c(C)c2c(c(C)c1OCc1ccc3ccccc3n1)CCC1(CCC1)O2

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 6/20 0.42
CYSLTR2 Q9NS75 4/20 0.42
ALOX5AP P20292 6/20 0.39
GPBAR1 Q8TDU6 4/20 0.38
PDE10A Q9Y233 2/20 0.38
PSEN1 P49768 1/20 0.36

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
SCHEMBL8421050 0.83 PSEN1 (0.58) CYSLTR1CYSLTR2GPBAR1PSEN1
SCHEMBL7844524 0.78 PSEN1 (0.44) CYSLTR1CYSLTR2PSEN1
SCHEMBL13756700 0.77 BCHE (0.37) PDE10A
SCHEMBL4468647 0.77 MEN1 (0.37) PDE10A
SCHEMBL7841656 0.74 CYSLTR2 (0.41) CYSLTR1CYSLTR2PSEN1
SCHEMBL7841706 0.74 CYSLTR2 (0.41) CYSLTR1CYSLTR2PSEN1
SCHEMBL4462587 0.69 KDM4E (0.39) CYSLTR1CYSLTR2PDE10A
SCHEMBL4470237 0.69 KDM4E (0.39) CYSLTR1CYSLTR2PDE10A
SCHEMBL2914379 0.67 CYSLTR1 (0.37) CYSLTR1CYSLTR2ALOX5APGPBAR1PDE10A
SCHEMBL6373533 0.67 ALOX5AP (0.44) CYSLTR1CYSLTR2ALOX5APGPBAR1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576094-B2 Spiro derivatives as lipoxygenase inhibitors ELI LILLY AND COMPANY (US) 2009-08-18 US claimed
EP-1836183-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS Galileo Pharmaceuticals, Inc. (US) 2007-09-26 EP claimed
WO-2006065686-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS GALILEO PHARMACEUTICALS, INC. (US) 2006-06-22 WO claimed
US-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors GALILEO PHARMACEUTICALS, INC. 2006-06-15 US claimed
US-7576094-B2 Spiro derivatives as lipoxygenase inhibitors ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed
EP-1836183-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS Galileo Pharmaceuticals, Inc. (US) 2007-09-26 EP disclosed
WO-2006065686-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS GALILEO PHARMACEUTICALS, INC. (US) 2006-06-22 WO disclosed
US-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors GALILEO PHARMACEUTICALS, INC. 2006-06-15 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 (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-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors ALOX15B, ALOX5, ALOX15 CYSLTR1 108/4885CYSLTR2 111/4885ALOX5AP 5/4885

“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.