SCHEMBL3928696

SCHEMBL3928696

CCNS(=O)(=O)c1cc2ccccc2cc1CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.43
▸ CA9 Q16790 5/20 0.43
▸ ALDH1A1 P00352 5/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MMP2 P08253 3/20 0.40
▸ MMP8 P22894 3/20 0.40
▸ MMP12 P39900 3/20 0.40
▸ MMP13 P45452 3/20 0.40
▸ MMP14 P50281 3/20 0.40
▸ MMP16 P51512 3/20 0.40
▸ MMP9 P14780 2/20 0.40
▸ SQSTM1 Q13501 1/20 0.40
▸ KEAP1 Q14145 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL3931527 0.85 L3MBTL1 (0.45) ALDH1A1KMT2AMEN1KDM4ETDP1
SCHEMBL3927379 0.75 MEN1 (0.46) ALDH1A1KMT2AMEN1TDP1SMN1; SMN2
SCHEMBL29131708 0.74 TDP1 (0.61) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL13320282 0.70 CA12 (0.79) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL396300 0.69 CA12 (0.47) CA12CA9ALDH1A1KMT2ALMNA
SCHEMBL29403823 0.69 POLB (0.49) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL22409224 0.69 POLB (0.49) CA12CA9ALDH1A1KMT2AMEN1
SCHEMBL2766417 0.68 ALDH1A1 (0.52) ALDH1A1KMT2ALMNA
SCHEMBL218722 0.68 AKR1B1 (0.61) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL12936006 0.68 TDP1 (0.58) ALDH1A1KMT2AMEN1KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7534787-B2 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-19 — — US disclosed
US-20090099159-A1 Method of Treating Diseases and Conditions Associated with an Altered Level of Amyloid Beta Peptides and New Enolcarboxamide Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-16 — — US disclosed
US-7393843-B2 Method of treating diseases and conditions associated with an altered level of amyloid β peptides and new enolcarboxamide compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-07-01 — — US disclosed
US-20080139541-A1 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds BORNEMANN KLAUS 2008-06-12 — — US disclosed
US-7375220-B2 Method of treating diseases and conditions associated with an altered level of amyloid β peptides and new enolcarboxamide compounds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2008-05-20 — — US disclosed
EP-1750719-A2 TREATMENT OF DISEASES ASSOCIATED WITH ALTERED LEVEL OF AMYLOID BETA PEPTIDES Boehringer Ingelheim International GmbH (DE) 2007-02-14 — — EP disclosed
US-20060040928-A1 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2006-02-23 — — US disclosed
US-20050277635-A1 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-12-15 — — US disclosed
WO-2005110422-A2 TREATMENT OF DISEASES ASSOCIATED WITH ALTERED LEVEL OF AMYLOID BETA PEPTIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 — — 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 (4 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-20060040928-A1 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds APP, BACE1, PSEN1 CA12 2380/4885CA9 2541/4885ALDH1A1 1191/4885
US-20090099159-A1 Method of Treating Diseases and Conditions Associated with an Altered Level of Amyloid Beta Peptides and New Enolcarboxamide Compounds APP, BACE1, PSEN1 CA12 2380/4885CA9 2541/4885ALDH1A1 1191/4885
US-20050277635-A1 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds APP, BACE1, PSEN1 CA12 2380/4885CA9 2541/4885ALDH1A1 1191/4885
US-20080139541-A1 Method of treating diseases and conditions associated with an altered level of amyloid beta peptides and new enolcarboxamide compounds APP, BACE1, PSEN1 CA12 2513/4885CA9 2556/4885ALDH1A1 1177/4885

“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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