SCHEMBL3099749

SCHEMBL3099749

CC(Oc1cnc2c(c1)c(SC(C)(C)C)c(CC(C)(C)C(=O)O)n2Cc1ccc(-c2ccc(F)cn2)cc1)c1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 20/20 0.59
CYP2C9 P11712 5/20 0.59
CYP3A4 P08684 4/20 0.59
PTGS1 P23219 1/20 0.54
CYP2D6 P10635 1/20 0.50

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
SCHEMBL3099809 0.92 ALOX5AP (0.60) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6
SCHEMBL167235 0.92 ALOX5AP (0.70) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6
SCHEMBL20475176 0.92 ALOX5AP (0.70) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6
SCHEMBL3096211 0.88 ALOX5AP (0.69) ALOX5APCYP2C9CYP3A4
SCHEMBL3105537 0.88 ALOX5AP (0.69) ALOX5APCYP2C9CYP3A4
SCHEMBL3094559 0.88 ALOX5AP (0.73) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6
SCHEMBL3105482 0.86 ALOX5AP (0.59) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6
SCHEMBL3083707 0.86 ALOX5AP (0.67) ALOX5APPTGS1
SCHEMBL3105490 0.85 ALOX5AP (0.58) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6
SCHEMBL3478543 0.84 ALOX5AP (0.70) ALOX5APCYP2C9CYP3A4PTGS1CYP2D6

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-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 4/4885CYP2C9 2125/4885CYP3A4 912/4885
US-20070123522-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.