SCHEMBL3694201

SCHEMBL3694201

CCCC(C(=O)OC)n1c(=O)c2ccccc2n(C(C)c2c[nH]c3cccc(C)c23)c1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ PTGS2 P35354 1/20 0.34
▸ FFAR1 O14842 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ GPR139 Q6DWJ6 1/20 0.33
▸ CNR2 P34972 1/20 0.32
▸ NPY5R Q15761 1/20 0.32
▸ ALOX5 P09917 1/20 0.32

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
SCHEMBL3684612 0.93 L3MBTL1 (0.43) CMA1L3MBTL1PTGS2KMT2A
SCHEMBL3684609 0.93 L3MBTL1 (0.43) CMA1L3MBTL1PTGS2KMT2A
SCHEMBL3686010 0.93 L3MBTL1 (0.43) CMA1L3MBTL1PTGS2KMT2A
SCHEMBL3681840 0.91 CMA1 (0.47) CMA1FFAR1GPR84KMT2A
SCHEMBL3681842 0.91 CMA1 (0.47) CMA1FFAR1GPR84KMT2A
SCHEMBL3699285 0.91 CMA1 (0.47) CMA1FFAR1GPR84KMT2A
SCHEMBL3689846 0.90 CMA1 (0.36) CMA1L3MBTL1PTGS2FFAR1GPR84
SCHEMBL3689843 0.90 CMA1 (0.36) CMA1L3MBTL1PTGS2FFAR1GPR84
SCHEMBL3690079 0.90 CMA1 (0.39) CMA1FFAR1GPR84KMT2AGPR139
SCHEMBL3690074 0.90 CMA1 (0.39) CMA1FFAR1GPR84KMT2AGPR139

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
US-8377949-B2 Quinazolinedione chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-02-19 — — US disclosed
EP-2188277-B1 QUINAZOLINEDIONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2012-11-21 — — EP disclosed
US-20120122863-A1 Quinazolinedione Chymase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-17 — — US disclosed
EP-2188277-A1 QUINAZOLINEDIONE CHYMASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2010-05-26 — — EP disclosed
WO-2009023655-A1 QUINAZOLINEDIONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-19 — — 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-20120122863-A1 Quinazolinedione Chymase Inhibitors CMA1, CTSC, TPSG1 CMA1 1/4885L3MBTL1 4042/4885PTGS2 1440/4885

“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.

Send feedback