SCHEMBL6694192

SCHEMBL6694192

O=C1N[C@H](CCC#Cc2cc(CC3CCOCC3)cc3c(O)c(C(=O)NCc4ccc(Cl)cc4)nnc23)CO1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CACNA1C Q13936 3/20 0.33
SCN5A Q14524 3/20 0.33
KCNH2 Q12809 2/20 0.33
MAPK1 P28482 1/20 0.32
POLA1 P09884 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
CACNA1G O43497 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6699576 0.89 POLA1 (0.42) KCNH2POLA1
SCHEMBL6669974 0.87 MAPK1 (0.37) KCNH2MAPK1POLA1EGLN1KMT2A
SCHEMBL6669028 0.86 MAPK1 (0.39) KCNH2MAPK1POLA1EGLN1KMT2A
SCHEMBL6691671 0.85 CACNA1C (0.35) CACNA1CSCN5AKCNH2MAPK1POLA1
SCHEMBL6700225 0.85 POLA1 (0.35) CACNA1CSCN5AKCNH2POLA1MEN1
SCHEMBL6667328 0.83 MAPK1 (0.37) KCNH2MAPK1POLA1EGLN1MEN1
SCHEMBL6669484 0.81 MAPK1 (0.36) MAPK1POLA1EGLN1MEN1KMT2A
SCHEMBL6667340 0.80 PTGER4 (0.34) MAPK1EGLN1MEN1KMT2A
SCHEMBL6669978 0.76 MAPK1 (0.38) KCNH2MAPK1EGLN1KMT2A
SCHEMBL6695866 0.76 NPC1 (0.33) KCNH2MAPK1POLA1EGLN1KMT2A

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-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-04-08 US claimed
EP-1265872-A1 4-HYDROXYCINNOLINE-3-CARBOXYAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-18 EP claimed
US-6458788-B1 VIRICIDES; HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-10-01 US claimed
US-20020042397-A1 4-hydroxycinnoline-3-carboxyamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-04-11 US claimed
WO-2001081318-A1 4-HYDROXYCINNOLINE-3-CARBOXYAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-11-01 WO claimed
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-04-08 US disclosed
EP-1265872-A1 4-HYDROXYCINNOLINE-3-CARBOXYAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-18 EP disclosed
US-6458788-B1 VIRICIDES; HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-10-01 US disclosed
US-20020042397-A1 4-hydroxycinnoline-3-carboxyamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-04-11 US disclosed
WO-2001081318-A1 4-HYDROXYCINNOLINE-3-CARBOXYAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-11-01 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-20020042397-A1 4-hydroxycinnoline-3-carboxyamides as antiviral agents HAVCR2, ZC3HAV1, HCFC1 CACNA1C 1062/4885SCN5A 2566/4885KCNH2 1186/4885
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, MSR1, NR1H2 CACNA1C 3984/4885SCN5A 4332/4885KCNH2 4046/4885

“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.