SCHEMBL7369016

SCHEMBL7369016

COC(=O)C(O)C(N)CCCNC(N)=N[N+](=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.35
▸ NOS1 P29475 1/20 0.34
▸ ADAM17 P78536 1/20 0.32
▸ DDAH1 O94760 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ LTA4H P09960 1/20 0.30

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
L-Name SCHEMBL29362113 0.85 NOS1 (0.41) F2NOS1ADAM17DDAH1TSHR
L-Name SCHEMBL5966636 0.85 NOS1 (0.41) F2NOS1ADAM17DDAH1TSHR
Hydrochloric Acid SCHEMBL7365158 0.84 DDAH1 (0.38) F2NOS1ADAM17DDAH1
L-Name SCHEMBL6054203 0.81 NOS1 (0.38) F2NOS1ADAM17DDAH1TSHR
SCHEMBL8376062 0.79 MEN1 (0.38) F2
SCHEMBL13084706 0.78 NOS1 (0.36) F2NOS1ADAM17DDAH1
SCHEMBL12237928 0.78 NOS1 (0.36) F2NOS1ADAM17DDAH1
SCHEMBL14350781 0.76 NOS1 (0.40) F2NOS1ADAM17DDAH1
SCHEMBL12556165 0.76 MEN1 (0.39) F2NOS1ADAM17DDAH1LTA4H
SCHEMBL12556286 0.76 MEN1 (0.39) F2NOS1ADAM17DDAH1LTA4H

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
EP-0664786-B1 ARGININE KETO-AMIDE ENZYME INHIBITORS CORVAS INT INC (US) 1999-03-24 — — EP disclosed
US-5869454-A ANTICOAGULANTS CORVAS INTERNATIONAL, INC. (US) 1999-02-09 — — US disclosed
US-5670479-A α-ketoamide derivatives as inhibitors of thrombosis CORVAS INTERNATIONAL, INC. (US) 1997-09-23 — — US disclosed
US-5656600-A MODIFIED POLYPEPTIDES CORVAS INTERNATIONAL, INC. (US) 1997-08-12 — — US disclosed
US-5597804-A ANTITHROMBOTIC AGENTS CORVAS INTERNATIONAL, INC. (US) 1997-01-28 — — US disclosed
EP-0693083-A4 ALPHA-KETOAMIDE DERIVATIVES AS INHIBITORS OF THROMBOSIS CORVAS INT INC (US) 1996-07-17 — — EP disclosed
EP-0693083-A1 ALPHA-KETOAMIDE DERIVATIVES AS INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1996-01-24 — — EP disclosed
US-5371072-A ANTICOAGULANTS CORVAS INTERNATIONAL, INC. (US) 1994-12-06 — — US disclosed
WO-1994021673-A1 ALPHA-KETOAMIDE DERIVATIVES AS INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1994-09-29 — — WO disclosed
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