SCHEMBL594166

SCHEMBL594166

O=C(O)C(CO)N(Cc1ccccc1)[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ CPA1 P15085 6/20 0.43
▸ CES2 O00748 1/20 0.40
▸ CES1 P23141 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ LMNA P02545 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GSR P00390 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37

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
SCHEMBL594167 1.00 CRHBP (0.43) CRHBPCRHR2CPA1CES2CES1
SCHEMBL4088187 0.86 CPA3 (0.42) CRHBPCRHR2CPA1CES2CES1
SCHEMBL4088184 0.86 CPA3 (0.42) CRHBPCRHR2CPA1CES2CES1
SCHEMBL20856984 0.81 FNTA (0.47) CRHBPCRHR2CPA1
SCHEMBL16599213 0.80 EPOR (0.47) CRHBPCRHR2CPA1
SCHEMBL16599212 0.80 EPOR (0.47) CRHBPCRHR2CPA1
SCHEMBL20522200 0.78 KDM6B (0.47) CRHBPCRHR2CPA1
SCHEMBL20522201 0.78 KDM6B (0.47) CRHBPCRHR2CPA1
SCHEMBL3126205 0.76 KMT2A (0.49) ALDH1A1LMNAMEN1KMT2ACYP1A2
SCHEMBL2855957 0.76 KMT2A (0.49) ALDH1A1LMNAMEN1KMT2ACYP1A2

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 121 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1807515-A4 ORTHOGONAL TRANSLATION COMPONENTS FOR THE IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS SCRIPPS RESEARCH INST (US) 2008-06-18 — — EP claimed
EP-1807515-A2 ORTHOGONAL TRANSLATION COMPONENTS FOR THE IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS The Scripps Research Institute (US) 2007-07-18 — — EP claimed
WO-2006110182-A2 ORTHOGONAL TRANSLATION COMPONENTS FOR THE IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS THE SCRIPPS RESEARCH INSTITUTE (US) 2006-10-19 — — WO claimed
CN-1095069-A Novel process for the preparation and/or purification of clavulanic acid or pharmaceutically acceptable salts or esters thereof SMITHKLINE BEECHAM PLC (GB) 1994-11-16 — — CN claimed
US-20250376709-A1 PAPB AS A BIMOIETY-DEPENDENT THIOETHER INSTALLATION TOOL UNIV UTAH RES FOUND (US) 2025-12-11 — — US disclosed
US-12404512-B2 Method for optimizing antibody expression AMBRX, INC. (US) 2025-09-02 — — US disclosed
EP-3788149-B1 A METHOD FOR OPTIMIZING ANTIBODY EXPRESSION AMBRX INC (US) 2025-08-27 — — EP disclosed
WO-2025085727-A1 PAPB AS A BIMOIETY-DEPENDENT THIOETHER INSTALLATION TOOL BANDARIAN VAHE (US) 2025-04-24 — — WO disclosed
WO-2025085723-A1 THIOETHER CROSSLINKS IN C-TERMINAL AND N-TERMINAL MODIFIED PEPTIDES UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2025-04-24 — — WO disclosed
EP-4508235-A2 PAPB AS A BIMOIETY-DEPENDENT THIOETHER INSTALLATION TOOL University of Utah Research Foundation (US) 2025-02-19 — — EP disclosed
CN-119410678-A Method for optimizing antibody expression AMBRX公司 2025-02-11 — — CN disclosed
CN-119410679-A Method for optimizing antibody expression AMBRX公司 2025-02-11 — — CN disclosed
CN-1258298-A Process for preparation of metal salt of clavulanic acid SMITHKLINE BEECHAM PLC (GB) 2000-06-28 — — CN disclosed
CN-1041934-C Novel process SMITHKLINE BEECHAM PLC (GB) 1999-02-03 — — CN disclosed
CN-1179161-A Clavulanic acid extractim process SMITHKLINE BEECHAM PLC (GB) 1998-04-15 — — CN disclosed
CN-1037967-C novel intermediates and their use for the preparation of clavulanic acid SMITHKLINE BEECHAM PLC (GB) 1998-04-08 — — CN disclosed
CN-1036592-C Novel method for preparation and/or purification of clavulanic acid or pharmaceutical salt or ester of same SMITHKLINE BEECHAM PLC (GB) 1997-12-03 — — CN disclosed
CN-1113244-A Novel process SMITHKLINE BEECHAM PLC (GB) 1995-12-13 — — CN disclosed
CN-1112928-A Novel method for preparation and/or purification of clavulanic acid or pharmaceutical salt or ester of same SMITHKLINE BEECHAM PLC (GB) 1995-12-06 — — CN disclosed
CN-1095069-A Novel process for the preparation and/or purification of clavulanic acid or pharmaceutically acceptable salts or esters thereof SMITHKLINE BEECHAM PLC (GB) 1994-11-16 — — CN disclosed
Send feedback