SCHEMBL6768612

SCHEMBL6768612

Cc1ccc(C)c(CNc2ccc3oc4ccc(Cl)cc4c3c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.41
MAPT P10636 4/20 0.40
GAA P10253 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CASP1 P29466 2/20 0.40
KMT2A Q03164 2/20 0.40
USP2 O75604 1/20 0.40
HBB P68871 1/20 0.40
ALB P02768 2/20 0.40
IDH1 O75874 3/20 0.38
ADORA3 P0DMS8 1/20 0.37
PPARG P37231 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
NR2E3 Q9Y5X4 1/20 0.37
NCOR2 Q9Y618 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
GLA P06280 1/20 0.36

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
SCHEMBL6768755 0.90 MAPT (0.52) AHRMAPTGAAKDM4EMEN1
SCHEMBL6769611 0.87 MAPT (0.42) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL6482983 0.86 MAOB (0.45) AHRMAPTGAAKDM4EMEN1
SCHEMBL6498257 0.86 PPARG (0.51) AHRMAPTGAAMEN1ALDH1A1
SCHEMBL6494169 0.85 MAPT (0.40) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL6483043 0.78 CYP2C9 (0.48) AHRMAPTKDM4EMEN1ALDH1A1
SCHEMBL6768361 0.76 MAPT (0.54) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL6769319 0.75 AHR (0.42) AHRMAPTKDM4EMEN1ALDH1A1
SCHEMBL6490881 0.75 MAPT (0.53) AHRMAPTGAAKDM4EMEN1
SCHEMBL6495210 0.75 MEN1 (0.62) AHRMAPTGAAKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6800656-B2 Tricyclic compounds and method of treating herpes virus WARNER LAMBERT COMPANY 2004-10-05 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-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 (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-20030229073-A1 Tricyclic compounds and method of treating herpes virus HDAC8, ZC3HAV1, ZCCHC8 AHR 2670/4885MAPT 2337/4885GAA 1524/4885

“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.