SCHEMBL6693995

SCHEMBL6693995

Cc1nc2c(cc1C#CCO)c(=O)c(C(=O)NCc1ccc(Cl)cc1)cn2C

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
KCNH2 Q12809 1/20 0.46
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL6690166 0.89 MAPT (0.45) MAPTKCNH2MEN1KMT2A
SCHEMBL6780769 0.83 MAPT (0.51) MAPTKCNH2ADORA2AADORA1MEN1
SCHEMBL6284275 0.82 MAPT (0.48) MAPTKCNH2MEN1KMT2A
SCHEMBL6669830 0.81 MAPT (0.49) MAPTKCNH2MEN1KMT2A
SCHEMBL6692319 0.81 MAPT (0.47) MAPTKCNH2ADORA2AADORA1MEN1
SCHEMBL6668589 0.78 MAPT (0.61) MAPTMEN1KMT2A
SCHEMBL6286401 0.78 MAPT (0.54) MAPTKCNH2MEN1KMT2A
SCHEMBL6706654 0.77 KCNH2 (0.60) KCNH2
SCHEMBL6699580 0.77 EGLN1 (0.43) ADORA2AADORA1MEN1KMT2A
SCHEMBL6281296 0.77 KCNH2 (0.49) MAPTKCNH2MEN1KMT2A

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
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-04-08 US claimed
US-20020177604-A1 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents VAILLANCOURT VALERIE A (US) 2002-11-28 US claimed
US-6451811-B2 HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-09-17 US claimed
US-20020019413-A1 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-02-14 US claimed
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-04-08 US disclosed
US-6693114-B2 N-(4-CHLOROBENZYL)-6-(3-HYDROXY-1-PROPYNYL)-1-7-DIMETHYL-4-OXO-1,4 -DIHYDRO(1,8) NAPHTHYRIDINE-3-CARBOXAMIDE FOR EXAMPLE; INHIBITING VIRAL DNA POLYMERASE; TREATING HERPES VIRUS INFECTIONS PHARMACIA & UPJOHN COMPANY 2004-02-17 US disclosed
EP-1265895-A1 4-OXO-1,4-DIHYDRO 1,8]NAPHTHYRIDINE-3-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-18 EP disclosed
US-20020177604-A1 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents VAILLANCOURT VALERIE A (US) 2002-11-28 US disclosed
US-6451811-B2 HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-09-17 US disclosed
US-20020019413-A1 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-02-14 US disclosed
WO-2001074816-A1 4-OXO-1,4-DIHYDRO[1,8]NAPHTHYRIDINE-3-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-11 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-20020019413-A1 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents IRF3, ZC3HAV1, EIF2AK2 MAPT 4263/4885KCNH2 1345/4885ADORA2A 3464/4885
US-20020177604-A1 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents IRF3, ZC3HAV1, EIF2AK2 MAPT 4263/4885KCNH2 1345/4885ADORA2A 3464/4885
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, MSR1, NR1H2 MAPT 4862/4885KCNH2 4046/4885ADORA2A 972/4885

“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.