SCHEMBL6635510

SCHEMBL6635510

NCc1ccccc1C(F)(F)F.OC(=S)c1ccc2cnccc2n1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TRPV1 Q8NER1 1/20 0.39
CNR2 P34972 2/20 0.38
CTSA P10619 2/20 0.36
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
ROCK1 Q13464 1/20 0.34
IDO1 P14902 2/20 0.33
CNR1 P21554 1/20 0.33
MAOB P27338 1/20 0.33
NR3C2 P08235 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
SGMS2 Q8NHU3 1/20 0.32
PIEZO1 Q92508 1/20 0.31

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
SCHEMBL5179531 0.89 TRPV1 (0.43) ALDH1A1KDM4EMAPTSMN1; SMN2TRPV1
SCHEMBL8132969 0.80 MEN1 (0.46) ALDH1A1KDM4EMAPTSMN1; SMN2CNR2
SCHEMBL8154430 0.78 KDM4E (0.44) ALDH1A1KDM4EMAPTSMN1; SMN2CNR2
SCHEMBL6641987 0.77 CTSA (0.38) ALDH1A1KDM4ECTSAROCK1
SCHEMBL4894482 0.77 CTSA (0.40) ALDH1A1KDM4EMAPTSMN1; SMN2CNR2
SCHEMBL5090132 0.76 TRPV1 (0.56) TRPV1CNR2CTSALMNAMAPK1
SCHEMBL43013 0.69 IDO1 (0.61) ALDH1A1KDM4EIDO1MAOB
SCHEMBL6640812 0.69 ROCK2 (0.44) MAPTCNR2ROCK1IDO1MAOB
Hydrochloric Acid SCHEMBL6169962 0.68 IDO1 (0.62) ALDH1A1KDM4EIDO1MAOB
Methane SCHEMBL27580279 0.68 IDO1 (0.59) ALDH1A1KDM4EIDO1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0984967-B1 NAPHTHYRIDINE DERIVATIVES AND THEIR ANALOGUES INHIBITING CYTOMEGALOVIRUS IAF BIOCHEM INT (CA) 2004-02-25 EP claimed
EP-1037633-B1 ANTIVIRAL COMPOUNDS IAF BIOCHEM INT (CA) 2003-09-10 EP claimed
US-20010031765-A1 Antiviral compounds BIOCHEM PHARMA INC. 2001-10-18 US claimed
EP-1037633-A1 ANTIVIRAL COMPOUNDS BIOCHEM PHARMA INC (CA) 2000-09-27 EP claimed
WO-1999029318-A1 ANTIVIRAL COMPOUNDS BIOCHEM PHARMA INC. (CA) 1999-06-17 WO claimed
EP-0984967-B1 NAPHTHYRIDINE DERIVATIVES AND THEIR ANALOGUES INHIBITING CYTOMEGALOVIRUS IAF BIOCHEM INT (CA) 2004-02-25 EP disclosed
EP-1037633-B1 ANTIVIRAL COMPOUNDS IAF BIOCHEM INT (CA) 2003-09-10 EP disclosed
US-6534520-B2 Antiviral compounds BIOCHEM PHARMA INC. (CA) 2003-03-18 US disclosed
US-6255318-B1 CYTOMEGLO VIRUS BIOCHEM PHARMA INC. (CA) 2001-07-03 US disclosed
EP-1037633-A1 ANTIVIRAL COMPOUNDS BIOCHEM PHARMA INC (CA) 2000-09-27 EP disclosed
EP-0984967-A1 NAPHTHYRIDINE DERIVATIVES AND THEIR ANALOGUES INHIBITING CYTOMEGALOVIRUS BIOCHEM PHARMA INC (CA) 2000-03-15 EP disclosed
WO-1999029318-A1 ANTIVIRAL COMPOUNDS BIOCHEM PHARMA INC. (CA) 1999-06-17 WO disclosed
WO-1997034894-A1 NAPHTHYRIDINE DERIVATIVES AND THEIR ANALOGUES INHIBITING CYTOMEGALOVIRUS BIOCHEM PHARMA INC. (CA) 1997-09-25 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 (1 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-20010031765-A1 Antiviral compounds ZC3HAV1, IFNAR1, EIF2AK2 ALDH1A1 2126/4885KDM4E 1871/4885MAPT 4837/4885

“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.