SCHEMBL6606941

SCHEMBL6606941

CNc1cc(CN2CCOCC2)cc2c(O)c(C(=O)NCc3ccc(Cl)cc3)cnc12

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.53
KCNH2 Q12809 7/20 0.52
RXFP1 Q9HBX9 1/20 0.46
F10 P00742 1/20 0.46
MLLT1 Q03111 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.44
ENPP2 Q13822 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL6200011 0.88 KCNH2 (0.53) POLA1KCNH2RXFP1F10MLLT1
SCHEMBL6770778 0.88 KCNH2 (0.53) POLA1KCNH2RXFP1F10MLLT1
SCHEMBL6726994 0.88 KCNH2 (0.55) POLA1KCNH2RXFP1F10MLLT1
SCHEMBL6727162 0.88 KCNH2 (0.49) POLA1KCNH2RXFP1F10ALDH1A1
SCHEMBL6201283 0.84 KCNH2 (0.54) POLA1KCNH2RXFP1F10MLLT1
SCHEMBL6733213 0.84 ALDH1A1 (0.51) POLA1KCNH2RXFP1ALDH1A1
SCHEMBL6200655 0.82 KCNH2 (0.48) POLA1KCNH2RXFP1F10MLLT1
SCHEMBL6202555 0.81 RXFP1 (0.49) POLA1KCNH2RXFP1MLLT1ALDH1A1
SCHEMBL6707995 0.81 KCNH2 (0.61) POLA1KCNH2RXFP1F10MLLT1
SCHEMBL6665763 0.81 KCNH2 (0.54) POLA1KCNH2RXFP1F10MLLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456208-A1 PYRIDOQUINOXALINE ANTIVIRALS PHARMACIA & UPJOHN COMPANY (US) 2004-09-15 EP disclosed
US-20040106596-A1 Pyridoquinoxaline antivirals PERRAULT WILLIAM R (US) 2004-06-03 US disclosed
US-6686356-B2 HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2004-02-03 US disclosed
US-20030130255-A1 PYRIDOQUINOXALINE ANTIVIRALS PHARMACIA & UPJOHN COMPANY 2003-07-10 US disclosed
WO-2003053972-A1 PYRIDOQUINOXALINE ANTIVIRALS PHARMACIA & UPJOHN COMPANY (US) 2003-07-03 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-20040106596-A1 Pyridoquinoxaline antivirals IFNAR1, ZC3HAV1, SARS1 POLA1 222/4885KCNH2 915/4885RXFP1 147/4885
US-20030130255-A1 PYRIDOQUINOXALINE ANTIVIRALS IFNAR1, ZC3HAV1, SARS1 POLA1 222/4885KCNH2 915/4885RXFP1 147/4885

“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.