SCHEMBL876202

SCHEMBL876202

N#CC1(c2ccc(-c3cnc(N)nc3)cn2)CCC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 4/20 0.50
ALOX5AP P20292 9/20 0.42
MAP4K4 O95819 1/20 0.41
FGFR1 P11362 6/20 0.38
FGFR4 P22455 6/20 0.38
FGFR3 P22607 4/20 0.37
FGFR2 P21802 3/20 0.37
FEN1 P39748 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
SCHEMBL10241776 0.83 MAP4K4 (0.57) MAP3K12ALOX5APMAP4K4
SCHEMBL20898739 0.81 MAP3K12 (0.40) MAP3K12MAP4K4FGFR1FGFR4FGFR3
SCHEMBL881807 0.78 ALOX5AP (0.45) ALOX5APMAP4K4
SCHEMBL10241314 0.76 MAP4K4 (0.53) MAP3K12ALOX5APMAP4K4
SCHEMBL15167079 0.76 MAP4K4 (0.39) MAP3K12MAP4K4FGFR1FGFR4FGFR3
SCHEMBL23601698 0.76 CHRNB4 (0.38) MAP3K12ALOX5APMAP4K4FGFR1FGFR4
SCHEMBL877334 0.74 MAP3K12 (0.35) MAP3K12MAP4K4FGFR1FGFR4FGFR3
SCHEMBL12940523 0.74 OPRM1 (0.37) MAP3K12MAP4K4FGFR1FGFR4FGFR3
SCHEMBL23008877 0.74 FFAR4 (0.39) MAP3K12MAP4K4FGFR1FGFR4FGFR3
SCHEMBL18033990 0.74 OPRM1 (0.38) MAP3K12FGFR1FGFR4FGFR3FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2619197-B1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INT (DE) 2015-08-05 EP disclosed
EP-2619197-B1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INT (DE) 2015-08-05 EP disclosed
US-8575201-B2 Oxadiazole inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-11-05 US disclosed
US-8575201-B2 Oxadiazole inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-11-05 US disclosed
US-8575201-B2 Oxadiazole inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-11-05 US disclosed
EP-2619197-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION Boehringer Ingelheim International GmbH (DE) 2013-07-31 EP disclosed
US-20120295896-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-22 US disclosed
US-20120295896-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-22 US disclosed
US-20120295896-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-22 US disclosed
WO-2012040139-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-03-29 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-20120295896-A1 OXADIAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION LTB4R, LTC4S, LTB4R2 MAP3K12 3168/4885ALOX5AP 16/4885MAP4K4 3673/4885

“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.