SCHEMBL3462840

SCHEMBL3462840

CCC(CC)(Cc1c(SC(C)(C)C)c2cc(OCc3cnc(C)cn3)ccc2n1Cc1ccc(-c2ncc(OC)cn2)cc1)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 20/20 0.76
CYP2C9 P11712 5/20 0.76
CYP3A4 P08684 4/20 0.76
PTGS1 P23219 3/20 0.76
ALOX5 P09917 1/20 0.59
LTC4S Q16873 1/20 0.59

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
SCHEMBL3462934 0.94 ALOX5AP (0.68) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL5524814 0.93 ALOX5AP (0.67) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL503158 0.93 ALOX5AP (0.87) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL503061 0.93 ALOX5AP (0.86) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL5537875 0.91 ALOX5AP (0.69) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL5524993 0.90 ALOX5AP (0.87) ALOX5APPTGS1ALOX5LTC4S
SCHEMBL3462267 0.89 ALOX5AP (0.76) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL5527082 0.89 ALOX5AP (0.74) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL3462884 0.88 ALOX5AP (0.68) ALOX5APCYP2C9CYP3A4PTGS1ALOX5
SCHEMBL3478637 0.87 ALOX5AP (0.76) ALOX5APCYP2C9CYP3A4PTGS1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-20 US claimed
EP-2144875-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS Amira Pharmaceuticals, Inc. (US) 2010-01-20 EP disclosed
WO-2008137609-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2008-11-13 WO disclosed
US-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-20 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-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 ALOX5AP 4/4885CYP2C9 2125/4885CYP3A4 912/4885

“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.