SCHEMBL6495412

SCHEMBL6495412

FC(F)(F)c1cccc(CNc2ccc3oc4ccccc4c3c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.49
FFAR4 Q5NUL3 1/20 0.49
APP P05067 2/20 0.48
ROCK2 O75116 2/20 0.45
PRKACA P17612 2/20 0.45
GSK3B P49841 2/20 0.45
CLK4 Q9HAZ1 2/20 0.45
MKNK2 Q9HBH9 2/20 0.45
CDC7 O00311 1/20 0.45
MAP4K4 O95819 1/20 0.45
PIM1 P11309 1/20 0.45
CDK2 P24941 1/20 0.45
HIPK2 Q9H2X6 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 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
SCHEMBL6495445 0.89 FFAR1 (0.48) FFAR1FFAR4APPROCK2PRKACA
SCHEMBL6482233 0.87 EPHX2 (0.54) FFAR1APPMAPTSMN1; SMN2HPGD
SCHEMBL6490356 0.83 HPGD (0.52) FFAR1APPROCK2CDC7CDK2
SCHEMBL6482295 0.82 HPGD (0.54) MAPTSMN1; SMN2HPGDKDM4EALDH1A1
SCHEMBL7246584 0.82 CYP1A2 (0.53) MAPTSMN1; SMN2HPGDKDM4EALDH1A1
SCHEMBL6480515 0.82 MAPK14 (0.45) ROCK2MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL6480507 0.81 HIF1A (0.51) MAPTSMN1; SMN2HPGDKDM4EALDH1A1
SCHEMBL6483310 0.81 MAOB (0.46) APPROCK2PRKACAGSK3BCLK4
SCHEMBL6497189 0.81 IDO1 (0.54) APPMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL7245463 0.80 MAOB (0.47) MAPTSMN1; SMN2HPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075332-A1 Tricyclic compounds with antiviral activity WARNER LAMBERT COMPANY 2005-04-07 US claimed
US-20030229073-A1 Tricyclic compounds and method of treating herpes virus BOOTH RICHARD JOHN (US) 2003-12-11 US claimed
EP-1248777-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2002-10-16 EP claimed
WO-2001051479-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2001-07-19 WO claimed
US-20050075332-A1 Tricyclic compounds with antiviral activity WARNER LAMBERT COMPANY 2005-04-07 US disclosed
US-6800656-B2 Tricyclic compounds and method of treating herpes virus WARNER LAMBERT COMPANY 2004-10-05 US disclosed
US-20030229073-A1 Tricyclic compounds and method of treating herpes virus BOOTH RICHARD JOHN (US) 2003-12-11 US disclosed
EP-1248777-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2002-10-16 EP disclosed
WO-2001051479-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2001-07-19 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-20030229073-A1 Tricyclic compounds and method of treating herpes virus HDAC8, ZC3HAV1, ZCCHC8 FFAR1 4196/4885FFAR4 3709/4885APP 4080/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 FFAR1 3974/4885FFAR4 3503/4885APP 4742/4885

“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.