SCHEMBL925818

SCHEMBL925818

O=Cc1cn2c(n1)SCC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.47
KMT2A Q03164 8/20 0.47
MEN1 O00255 7/20 0.47
TP53 P04637 1/20 0.47
GLA P06280 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NPC1 O15118 7/20 0.45
RAB9A P51151 7/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
GAA P10253 3/20 0.45
GFER P55789 1/20 0.45
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
HSD17B10 Q99714 3/20 0.44
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
NSD2 O96028 1/20 0.42

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
SCHEMBL7177869 0.89 MAPT (0.38) MAPTKMT2AMEN1TP53GLA
SCHEMBL7200327 0.87 MAPT (0.40) MAPTKMT2AMEN1TP53GLA
SCHEMBL8339941 0.71
SCHEMBL13248348 0.67 MAPT (0.49) MAPTKMT2AMEN1TP53GLA
SCHEMBL7181038 0.67 MAPT (0.49) MAPTKMT2AMEN1TP53GLA
SCHEMBL6947543 0.64 MAPT (0.45) MAPTKMT2AMEN1TP53GLA
SCHEMBL2927941 0.64 WDR5 (0.46) MAPTKMT2ATP53NPC1RAB9A
Lithium Ion SCHEMBL7175365 0.63 MAPT (0.45) MAPTKMT2AMEN1TP53GLA
SCHEMBL19185513 0.63 MAPT (0.46) MAPTKMT2AMEN1TP53GLA
SCHEMBL870366 0.63 ALDH1A1 (0.44) MAPTKMT2ATP53NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6600035-B1 Multistage reaction of forming penicillin antibiotics SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-29 US claimed
US-6037469-A BETA LACTAMASE INHIBITOR AND ANTIBACTERIAL; FOR TREATING BACTERIAL INFECTIONS IN HUMANS AND ANIMALS SMITHKLINE BEECHAM PLC (GB) 2000-03-14 US claimed
US-9884832-B2 Inhibitors targeting drug-resistant influenza A THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-02-06 US disclosed
US-20150191439-A1 INHIBITORS TARGETING DRUG-RESISTANT INFLUENZA A NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-09 US disclosed
US-RE44874-E1 Phenethanolamine derivatives for treatment of respiratory diseases GLAXO GROUP LIMITED (GB) 2014-04-29 US disclosed
EP-2042168-B1 Inhalation formulation comprising phenethanolamine derivatives for the treatment of respiratory diseases GLAXO GROUP LTD (GB) 2013-10-23 EP disclosed
US-8198483-B2 Phenethanolamine derivatives for treatment of respiratory diseases GLAXO GROUP LIMITED (GB) 2012-06-12 US disclosed
US-20110269970-A1 Phenethanolamine Derivatives for Treatment of Respiratory Diseases GLAXO GROUP LIMITED (GB) 2011-11-03 US disclosed
US-7982067-B2 Phenethanolamine derivatives for treatment of respiratory diseases GLAXO GROUP LIMITED (GB) 2011-07-19 US disclosed
US-20110009631-A1 Phenethanolamine Derivatives for Treatment of Respiratory Diseases GLAXO GROUP LIMITED (GB) 2011-01-13 US disclosed
US-7776895-B2 Inhalation devices for delivering phenethanolamine derivatives for the treatment of respiratory diseases GLAXO GROUP LIMITED (GB) 2010-08-17 US disclosed
US-6037469-A BETA LACTAMASE INHIBITOR AND ANTIBACTERIAL; FOR TREATING BACTERIAL INFECTIONS IN HUMANS AND ANIMALS SMITHKLINE BEECHAM PLC (GB) 2000-03-14 US disclosed
US-5939066-A TREATING OR PREVENTING A BACTERIAL INFECTION BY ADMINISTERING A LACTAMASE INHIBITORY EFFECTIVE AMOUNT OF A PENEM AND A LACTAM ANTIBIOTIC SMITHKLINE BEECHAM P.L.C. 1999-08-17 US disclosed
US-5911985-A IN COMBINATION WITH CARRIERS AND A LACTAM ANTIBIOTIC SMITHKLINE BEECHAM P.L.C. (GB) 1999-06-15 US disclosed
US-5776455-A PENICILLIN BACTERICIDES SMITHKLINE BEECHAM P.L.C. (GB) 1998-07-07 US disclosed
EP-0758240-A1 PHARMACEUTICAL FORMULATIONS CONTAINING A BETA-LACTAMASE INHIBITING PENEM IN COMBINATION WITH A BETA-LACTAM ANTIBIOTIC AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS SMITHKLINE BEECHAM PLC (GB) 1997-02-19 EP disclosed
US-5602250-A ANTIBIOTICS, BETA-LACTAMASE INHIBITORS SMITHKLINE BEECHAM P.L.C. (GB) 1997-02-11 US disclosed
WO-1995028935-A1 PHARMACEUTICAL FORMULATIONS CONTAINING A BETA-LACTAMASE INHIBITING PENEM IN COMBINATION WITH A BETA-LACTAM ANTIBIOTIC AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS SMITHKLINE BEECHAM PLC (GB) 1995-11-02 WO disclosed
EP-0666862-A1 6-(SUBSTITUTED METHYLENE) PENEMS AND INTERMEDIATES SMITHKLINE BEECHAM PLC (GB) 1995-08-16 EP disclosed
WO-1994010178-A1 6-(SUBSTITUTED METHYLENE) PENEMS AND INTERMEDIATES SMITHKLINE BEECHAM P L C (GB) 1994-05-11 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 (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-20150191439-A1 INHIBITORS TARGETING DRUG-RESISTANT INFLUENZA A HAVCR2, HDLBP, HSP90B1 MAPT 3871/4885KMT2A 4163/4885MEN1 3879/4885
US-20110269970-A1 Phenethanolamine Derivatives for Treatment of Respiratory Diseases PNMT, HRH2, CHKB MAPT 2476/4885KMT2A 257/4885MEN1 3658/4885
US-20110009631-A1 Phenethanolamine Derivatives for Treatment of Respiratory Diseases PHOSPHO1, PNMT, PEBP1 MAPT 1794/4885KMT2A 369/4885MEN1 1526/4885

“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.