SCHEMBL2632987

SCHEMBL2632987

CCCC[C@H](N)[C@H](O)C(=O)N[C@H](CC(=O)OC)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 3/20 0.48
▸ LAP3 P28838 2/20 0.45
▸ ANPEP P15144 1/20 0.45
▸ RNPEP Q9H4A4 1/20 0.45
▸ DNPEP Q9ULA0 1/20 0.45
▸ METAP2 P50579 4/20 0.44
▸ METAP1 P53582 3/20 0.44
▸ CSNK1E P49674 1/20 0.43
▸ IL1RN P18510 1/20 0.43
▸ ERAP2 Q6P179 1/20 0.43
▸ BIRC2 Q13490 1/20 0.42
▸ CTSK P43235 3/20 0.42
▸ CTSL P07711 1/20 0.42
▸ CTSB P07858 1/20 0.42
▸ CTSH P09668 1/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CNR2 P34972 1/20 0.41

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
SCHEMBL14265119 0.82 REN (0.41) RENBIRC2CTSKCTSLCTSB
SCHEMBL12829169 0.82 REN (0.52) RENBIRC2CTSKCTSLCTSB
SCHEMBL1486271 0.82 IL1RN (0.61) ANPEPIL1RNERAP2BIRC2
SCHEMBL12228016 0.77 CYP3A4 (0.47) CYP3A4MAPK1
SCHEMBL5812534 0.75 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPCSNK1E
SCHEMBL5812528 0.75 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPCSNK1E
SCHEMBL21570275 0.75 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPCSNK1E
SCHEMBL21570273 0.75 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPCSNK1E
SCHEMBL14611003 0.74 CTRB1 (0.53) RENCTSKCYP3A4MAPK1
SCHEMBL14392786 0.74 CTRB1 (0.53) RENCTSKCYP3A4MAPK1

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-20120197015-A1 EPOXYCARBOXAMIDE COMPOUND, AZIDE COMPOUND, AND AMINO ALCOHOL COMPOUND, AND PROCESS FOR PREPARING a-KETO AMIDE COMPOUND USING THEM SEIKAGAKU KOGYO KABUSHIKI KAISHA D/B/A SEIKAGAKU CORPORATION (JP) 2012-08-02 — — US disclosed
US-8163943-B2 Epoxycarboxamide compound, azide compound, and amino alcohol compound, and process for preparing α-keto amide compound using them SEIKAGAKU KOGYO KABUSHIKI KAISHA (JP) 2012-04-24 — — US disclosed
US-20080064873-A1 Oxidizing an amino alcohol (obtained by ring opening the epoxy, aziding, reducing and reacting it with a carboxylic acid); stereoselectivity; protease inhibitors: antiallergens; anticarcinogenic and hypotensive agents SEIKAGAKU KOGYO KABUSHIKI KAISHA D/B/A SEIKAGAKU CORPORATION (JP) 2008-03-13 — — US disclosed
US-20080058516-A1 Stereoselectivity; protease inhibitors: antiallergens; anticarcinogenic and hypotensive agents SEIKAGAKU KOGYO KABUSHIKI KAISHA D/B/A SEIKAGAKU CORPORATION (JP) 2008-03-06 — — US disclosed
US-7326799-B2 Oxidizing an amino alcohol (obtained by ring opening the epoxy, aziding, reducing and reacting it with a carboxylic acid); stereoselectivity; protease inhibitors: antiallergens; anticarcinogenic and hypotensive agents SEIKAGAKU KOGYO KABUSHIKI KAISHA (JP) 2008-02-05 — — 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 (3 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-20080064873-A1 Oxidizing an amino alcohol (obtained by ring opening the epoxy, aziding, reducing and reacting it with a carboxylic acid); stereoselectivity; protease inhibitors: antiallergens; anticarcinogenic and hypotensive agents REN, CMA1, AKR1A1 REN 1/4885LAP3 1340/4885ANPEP 31/4885
US-20120197015-A1 EPOXYCARBOXAMIDE COMPOUND, AZIDE COMPOUND, AND AMINO ALCOHOL COMPOUND, AND PROCESS FOR PREPARING a-KETO AMIDE COMPOUND USING THEM AKR1C1, AKR1C4, AADAC REN 786/4885LAP3 3767/4885ANPEP 379/4885
US-20080058516-A1 Stereoselectivity; protease inhibitors: antiallergens; anticarcinogenic and hypotensive agents CMA1, REN, TPSAB1 REN 2/4885LAP3 934/4885ANPEP 19/4885

“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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