SCHEMBL199461

SCHEMBL199461

O=C(O)C1NCCC1c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.47
AKR1C3 P42330 1/20 0.41
AKR1C1 Q04828 1/20 0.41
MEN1 O00255 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC4 P56524 1/20 0.40

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
SCHEMBL4780406 1.00 SLC1A2 (0.47) SLC1A2AKR1C3AKR1C1MEN1BLM
SCHEMBL5203561 1.00 SLC1A2 (0.47) SLC1A2AKR1C3AKR1C1MEN1BLM
SCHEMBL199463 1.00 SLC1A2 (0.47) SLC1A2AKR1C3AKR1C1MEN1BLM
SCHEMBL199462 1.00 SLC1A2 (0.47) SLC1A2AKR1C3AKR1C1MEN1BLM
SCHEMBL350996 1.00 SLC1A2 (0.47) SLC1A2AKR1C3AKR1C1MEN1BLM
Hydrochloric Acid SCHEMBL2297672 0.98 SLC1A2 (0.46) SLC1A2AKR1C3AKR1C1MEN1BLM
Hydrochloric Acid SCHEMBL2297675 0.98 SLC1A2 (0.46) SLC1A2AKR1C3AKR1C1MEN1BLM
SCHEMBL851578 0.89 MEN1 (0.50) SLC1A2MEN1BLMKMT2A
SCHEMBL16056887 0.89 MEN1 (0.50) SLC1A2MEN1BLMKMT2A
SCHEMBL4074609 0.89 MEN1 (0.50) SLC1A2MEN1BLMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019011879-A1 THERAPEUTIC FOR TREATING CAPILLARY LEAK SYNDROME HENNING RAINER (CH) 2019-01-17 WO claimed
US-20160076058-A1 HYDROCARBON-PRODUCING GENES AND METHODS OF THEIR USE GENOMATICA, INC. 2016-03-17 US claimed
US-20150353619-A1 Non-Canonical Insulins and Their Uses CALIFORNIA INSTITUTE OF TECHNOLOGY 2015-12-10 US claimed
US-8980843-B2 Leptin agonist and methods of use Temple University—Of the Commonwealth System of Higher Education (US) 2015-03-17 US claimed
EP-1937710-B1 KININ B1 RECEPTOR PEPTIDE AGONISTS AND USES THEREOF SOCPRA SCIENCES SANTE ET HUMAINES S E C (CA) 2012-10-17 EP claimed
US-20120129774-A1 KININ B1 RECEPTOR PEPTIDE AGONISTS AND USES THEREOF UNIVERSITE DE SHERBROOKE (CA) 2012-05-24 US claimed
US-8088890-B2 Peptides and peptidomimetic compounds, the manufacturing thereof as well as their use for preparing a therapeutically and/or preventively active pharmaceutical composition FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2012-01-03 US claimed
US-8076453-B2 Kinin B1 receptor peptide agonists and uses thereof Societe De Commercialisation Des Produits De La Recheche Appliquee-Socpra-Science Sante Et Humaines S.E.C. (CA) 2011-12-13 US claimed
EP-2328925-A1 PEPTIDES AND PEPTIDOMIMETIC COMPOUNDS, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION Fibrex Medical Research & Development GmbH (AT) 2011-06-08 EP claimed
US-7884074-B2 Compounds and methods for prevention and/or treatment of inflammation using the same Ikaria Development Subsidiary Two, LLC (US) 2011-02-08 US claimed
US-20090286739-A1 PEPTIDES, PEPTIDOMIMETICS AND DERIVATIVES THEREOF, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2009-11-19 US claimed
US-20090054347-A1 KININ B1 RECEPTOR PEPTIDE AGONISTS AND USES THEREOF UNIVERSITE DE SHERBROOKE (CA) 2009-02-26 US claimed
WO-2008147781-A2 HYDROCARBON-PRODUCING GENES AND METHODS OF THEIR USE LS9, INC. (US) 2008-12-04 WO claimed
EP-1937710-A1 KININ B1 RECEPTOR PEPTIDE AGONISTS AND USES THEREOF Université de Sherbrooke (CA) 2008-07-02 EP claimed
WO-2006128293-A1 KININ B1 RECEPTOR PEPTIDE AGONISTS AND USES THEREOF UNIVERSITé DE SHERBROOKE (CA) 2006-12-07 WO claimed
EP-0732399-A2 Chymotrypsin-like proteases and their inhibitors CEPHALON, INC. (US) 1996-09-18 EP claimed
EP-0518955-A4 CHYMOTRYPSIN-LIKE PROTEASES AND THEIR INHIBITORS 1993-09-22 EP claimed
WO-1993000359-A1 MODIFIED PEPTIDES TRANSPORTABLE INTO THE CENTRAL NERVOUS SYSTEM THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-01-07 WO claimed
EP-0518955-A1 CHYMOTRYPSIN-LIKE PROTEASES AND THEIR INHIBITORS CEPHALON, INC. (US) 1992-12-23 EP claimed
WO-1991013904-A1 CHYMOTRYPSIN-LIKE PROTEASES AND THEIR INHIBITORS CEPHALON, INC. (US) 1991-09-19 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20150353619-A1 Non-Canonical Insulins and Their Uses IAPP, IDE, INSR SLC1A2 537/4885AKR1C3 2293/4885AKR1C1 1951/4885
US-20090286739-A1 PEPTIDES, PEPTIDOMIMETICS AND DERIVATIVES THEREOF, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION NPR3, RXFP3, RXFP1 SLC1A2 2110/4885AKR1C3 3045/4885AKR1C1 3300/4885

“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.