SCHEMBL6319129

SCHEMBL6319129

CNCC(O)c1cnccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ADRA2A P08913 5/20 0.40
ADRA2B P18089 5/20 0.40
ADRA2C P18825 5/20 0.40
HIF1A Q16665 4/20 0.40
ADRB2 P07550 4/20 0.40
ADRA1A P35348 4/20 0.40
CYP3A4 P08684 4/20 0.40
CYP2D6 P10635 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
ADRB1 P08588 3/20 0.40
ADRB3 P13945 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
TSHR P16473 2/20 0.40
DRD1 P21728 2/20 0.40
ADRA1B P35368 2/20 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
SCHEMBL6278027 1.00 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2ADRA2AADRA2B
SCHEMBL6673370 0.82 KDM4E (0.44) KDM4EALDH1A1SMN1; SMN2ADRA2AADRA2B
SCHEMBL25225144 0.80 KDM4E (0.41) KDM4EALDH1A1SMN1; SMN2ADRB2ADRB1
SCHEMBL1579715 0.79 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2ADRA1ACYP2D6
SCHEMBL16619954 0.78 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2
SCHEMBL10714528 0.76 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2ADRA1ATSHR
SCHEMBL7973738 0.76 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2CYP2D6MAPT
SCHEMBL8508786 0.76 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2CYP2D6NFKB1
SCHEMBL7117628 0.75 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2ADRA1ATSHR
SCHEMBL6680046 0.75 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2ADRA1ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472260-A2 THIENO(3,2-B)PYRIDONES AS ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2004-11-03 EP claimed
WO-2003059878-A2 THIENO (3, 2-B) PYRIDONES AS ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 WO claimed
US-6861438-B2 Antiviral agents PFIZER (US) 2005-03-01 US disclosed
US-6852731-B2 Antiviral compounds PFIZER (US) 2005-02-08 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-1467999-A1 OXOTHIENO[3,2-B]PYRIDINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2004-10-20 EP disclosed
US-20040138449-A1 Antiviral agents PHARMACIA & UPJOHN COMPANY 2004-07-15 US disclosed
US-20040110787-A1 Heteroaryl-ethanolamine derivatives as antiviral agents PHARMACIA & UPJOHN COMPANY 2004-06-10 US disclosed
WO-2003059912-A1 OXOTHIENO (3, 2-B) PYRIDINECARBOXAMIDES AS 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 (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-20040242884-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, IRF3, IFNAR1 KDM4E 1156/4885ALDH1A1 1593/4885SMN1; SMN2 947/4885
US-20040110787-A1 Heteroaryl-ethanolamine derivatives as antiviral agents RPL35, ZC3HAV1, RPL5 KDM4E 775/4885ALDH1A1 971/4885SMN1; SMN2 4631/4885
US-20040138449-A1 Antiviral agents IRF3, IFNAR1, EIF2AK2 KDM4E 1593/4885ALDH1A1 1981/4885SMN1; SMN2 1122/4885

“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.