SCHEMBL3099829

SCHEMBL3099829

CC(C)(C)C(=O)c1c(CC(C)(C)C(=O)O)n(Cc2ccc(Cl)cc2)c2ncc(OCc3ccc4ccccc4n3)cc12

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 19/20 0.68
PTGS1 P23219 1/20 0.68
PTGS2 P35354 1/20 0.68
ALOX5 P09917 4/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2D6 P10635 1/20 0.64
CYP2C9 P11712 1/20 0.64

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
SCHEMBL2108321 0.89 PTGS1 (0.85) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL9252706 0.89 PTGS1 (0.84) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL9252681 0.89 PTGS1 (0.84) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL3103085 0.89 ALOX5AP (0.69) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL3096486 0.89 PTGS1 (0.64) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL3105521 0.87 ALOX5AP (0.81) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL5100978 0.87 ALOX5AP (0.67) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL3105535 0.87 ALOX5AP (0.69) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL3095923 0.87 ALOX5AP (0.69) ALOX5APPTGS1PTGS2ALOX5CYP3A4
SCHEMBL3099685 0.84 ALOX5AP (0.63) ALOX5APPTGS1PTGS2ALOX5CYP3A4

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
EP-1933842-B1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS PANMIRA PHARMACEUTICALS LLC (US) 2012-10-03 EP disclosed
US-7795274-B2 5-lipoxygenase-activating protein (FLAP) inhibitors AMIRA PHARMACEUTICALS INC. (US) 2010-09-14 US disclosed
US-20080227807-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2008-09-18 US disclosed
US-7405302-B2 5-lipoxygenase-activating protein (FLAP) inhibitors AMIRA PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
US-20070123522-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-05-31 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 (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-20080227807-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 ALOX5AP 4/4885PTGS1 27/4885PTGS2 41/4885
US-20070123522-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 ALOX5AP 4/4885PTGS1 27/4885PTGS2 41/4885

“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.