SCHEMBL3685602

SCHEMBL3685602

COC(=O)[C@H](c1ccccc1)n1c(=O)c2ccccc2n(C(C)c2c[nH]c3cccc(C)c23)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 2/20 0.39
▸ NR3C2 P08235 2/20 0.35
▸ MGAM O43451 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ SI P14410 2/20 0.33
▸ MGAM2 Q2M2H8 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ KAT2B Q92831 3/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ NOD2 Q9HC29 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ NR3C1 P04150 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ AR P10275 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ SLC6A2 P23975 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
SCHEMBL3679633 0.91 CMA1 (0.46) CMA1MGAMGAASIMGAM2
SCHEMBL3683769 0.91 CMA1 (0.46) CMA1MGAMGAASIMGAM2
SCHEMBL3686145 0.89 NPC1 (0.34) GAAMEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL3686142 0.89 NPC1 (0.34) GAAMEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL3688102 0.89 NPC1 (0.34) GAAMEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL3686010 0.86 L3MBTL1 (0.43) CMA1KMT2AL3MBTL1PGRAR
SCHEMBL3684612 0.86 L3MBTL1 (0.43) CMA1KMT2AL3MBTL1PGRAR
SCHEMBL3684609 0.86 L3MBTL1 (0.43) CMA1KMT2AL3MBTL1PGRAR
SCHEMBL3694201 0.84 CMA1 (0.38) CMA1KMT2AALOX5L3MBTL1
SCHEMBL3695212 0.84 CMA1 (0.35) CMA1MGAMGAASIMGAM2

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 1/4885NR3C2 1315/4885MGAM 417/4885

“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.

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