SCHEMBL6284338

SCHEMBL6284338

CN(CC(=O)c1ncccn1)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 2/20 0.36
WNT3A P56704 2/20 0.36
HTR2C P28335 1/20 0.36
SLC6A4 P31645 1/20 0.36
PDK2 Q15119 1/20 0.35
CACNA1G O43497 1/20 0.34
CACNA1B Q00975 1/20 0.34
CACNA1C Q13936 1/20 0.34
SSTR4 P31391 1/20 0.34
GBA1 P04062 1/20 0.34
P2RX7 Q99572 1/20 0.33
BUB1 O43683 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
PAX8 Q06710 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
CPB2 Q96IY4 1/20 0.32
AAK1 Q2M2I8 1/20 0.32

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
SCHEMBL24443475 0.82 SMN1; SMN2 (0.44) CTNNB1WNT3AHTR2CSLC6A4ALDH1A1
SCHEMBL29689474 0.82 SMN1; SMN2 (0.44) CTNNB1WNT3AHTR2CSLC6A4ALDH1A1
SCHEMBL20794554 0.79 HTR2C (0.43) HTR2CSLC6A4PDK2CACNA1GCACNA1B
SCHEMBL29689462 0.78 NFE2L2 (0.39) POLB
SCHEMBL6287407 0.76 CTNNB1 (0.46) CTNNB1WNT3AP2RX7ALDH1A1POLB
SCHEMBL15973703 0.76 ALDH1A1 (0.46) HTR2CSLC6A4GBA1ALDH1A1CTSL
SCHEMBL15973941 0.76 PLOD2 (0.47) ALDH1A1
SCHEMBL5159978 0.73 P2RX7 (0.41) CTNNB1WNT3AP2RX7ALDH1A1GPR119
SCHEMBL20524423 0.73 KMT2A (0.43) CTNNB1WNT3AHTR2CSLC6A4PDK2
SCHEMBL4676290 0.73 HTR2C (0.49) HTR2CSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878705-B2 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxamide antiviral agents PFIZER (US) 2005-04-12 US disclosed
US-6852731-B2 Antiviral compounds PFIZER (US) 2005-02-08 US disclosed
US-20040259907-A1 4-OXO-4,7-DIHYDROFURO[2,3-B]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY 2004-12-23 US disclosed
US-20040242884-A1 ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY 2004-12-02 US disclosed
EP-1472260-A2 THIENO(3,2-B)PYRIDONES AS ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2004-11-03 EP disclosed
EP-1465895-A2 4-OXO-4,7-DIHYDROFURO(2,3-B)PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2004-10-13 EP disclosed
WO-2003059911-A2 4-OXO-4, 7-DIHYDROFURO[2,3-b]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 WO disclosed
WO-2003059878-A2 THIENO (3, 2-B) PYRIDONES AS ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 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 (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-20040259907-A1 4-OXO-4,7-DIHYDROFURO[2,3-B]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS IL4, ZC3HAV1, IRF3 CTNNB1 4804/4885WNT3A 4416/4885HTR2C 3228/4885
US-20040242884-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, IRF3, IFNAR1 CTNNB1 4702/4885WNT3A 3544/4885HTR2C 3751/4885

“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.