SCHEMBL2989345

SCHEMBL2989345

CCOC(=O)c1c(C)csc1NC(=O)NC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ATM Q13315 1/20 0.50
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
ALDH1A1 P00352 7/20 0.47
NPSR1 Q6W5P4 5/20 0.47
MAPT P10636 3/20 0.47
POLB P06746 2/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
GSTO1 P78417 1/20 0.45
MAPK8 P45983 2/20 0.45
MAPK9 P45984 2/20 0.45
MAPK10 P53779 2/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 3/20 0.44
HPGD P15428 3/20 0.44

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
SCHEMBL2984306 0.87 ALDH1A1 (0.52) LMNAMEN1KMT2AATMADRA2A
SCHEMBL31392463 0.86 MAPK8 (0.54) LMNAMEN1KMT2AATMNPSR1
SCHEMBL2979292 0.86 MEN1 (0.54) LMNAMEN1KMT2AATMADRA2A
SCHEMBL11468077 0.85 TP53 (0.62) LMNAMEN1KMT2AATMADRA2A
SCHEMBL26474681 0.85 ALDH1A1 (0.53) LMNAMEN1KMT2AATMADRA2A
SCHEMBL2979294 0.85 LMNA (0.48) LMNAMEN1KMT2AATMADRA2A
SCHEMBL14882857 0.84 ADRA2A (0.52) LMNAMEN1KMT2AATMADRA2A
SCHEMBL13019308 0.84 SMN1; SMN2 (0.54) LMNAMEN1KMT2AATMADRA2A
SCHEMBL20014923 0.84 MAPK1 (0.58) LMNAMEN1KMT2AATMADRA2A
SCHEMBL2991353 0.83 MEN1 (0.55) LMNAMEN1KMT2AATMADRA2A

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776868-B2 Substituted bicyclic and tricyclic thieno[2,3-d]pyrimidines as A2A adenosine receptor antagonists GILEAD PALO ALTO, INC. (US) 2010-08-17 US disclosed
EP-2121705-A2 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2009-11-25 EP disclosed
EP-1989210-A2 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2008-11-12 EP disclosed
US-20080188495-A1 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. 2008-08-07 US disclosed
WO-2008070529-A2 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2008-06-12 WO disclosed
WO-2007103776-A2 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2007-09-13 WO disclosed
US-20070208040-A1 e.g. 3-ethyl-5-methyl-1,3-dihydrothiopheno[2,3-d]pyrimidine-2,4-dione; neurodegenerative disorders, antiischemic agent, antidepressant, attention deficit disorder, hepatic fibrosis, cirrhosis of the liver, and drug addiction GILEAD PALO ALTO, INC. 2007-09-06 US disclosed
EP-0311321-B1 Heterocyclic compounds and their preparation and use NOVO NORDISK AS (DK) 1994-01-12 EP disclosed
US-4866065-A ANTICONVULSANTS, ANXIOLYTIC AGENTS, HYPNOTICS, AND COGNITION ACTIVATORS A/S FERROSAN (DK) 1989-09-12 US disclosed
EP-0311321-A2 Heterocyclic compounds and their preparation and use NOVO NORDISK A/S (DK) 1989-04-12 EP 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 (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-20070208040-A1 e.g. 3-ethyl-5-methyl-1,3-dihydrothiopheno[2,3-d]pyrimidine-2,4-dione; neurodegenerative disorders, antiischemic agent, antidepressant, attention deficit disorder, hepatic fibrosis, cirrhosis of the liver, and drug addiction CHRNE, CHRNA3, CHRNA1 LMNA 4733/4885MEN1 4882/4885KMT2A 1438/4885
US-20080188495-A1 A2A ADENOSINE RECEPTOR ANTAGONISTS ADORA2A, ADORA3, ADORA1 LMNA 4583/4885MEN1 4883/4885KMT2A 1469/4885

“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.