SCHEMBL6497189

SCHEMBL6497189

Clc1cccc(CNc2ccc3oc4ccccc4c3c2)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.54
IGF1R P08069 2/20 0.54
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAOB P27338 1/20 0.47
AHR P35869 2/20 0.46
APP P05067 2/20 0.45
EGFR P00533 5/20 0.45
GAA P10253 1/20 0.44
ATM Q13315 1/20 0.44
PDE5A O76074 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ERBB2 P04626 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
SCHEMBL6493476 0.87 GABRP (0.44) IDO1IGF1RTP53MAPTSMN1; SMN2
SCHEMBL6493823 0.86 EGFR (0.50) IDO1IGF1RMAPTSMN1; SMN2MAOB
SCHEMBL7246584 0.86 CYP1A2 (0.53) IGF1RTP53MAPTSMN1; SMN2MAOB
SCHEMBL6482295 0.86 HPGD (0.54) IGF1RMAPTSMN1; SMN2MAOBEGFR
SCHEMBL6495487 0.85 MAOB (0.49) MAPTMAOBAHREGFRGAA
SCHEMBL6490356 0.84 HPGD (0.52) MAPTMAOBAPPKDM4EALDH1A1
SCHEMBL6483310 0.84 MAOB (0.46) TP53MAPTSMN1; SMN2MAOBAPP
SCHEMBL6480507 0.84 HIF1A (0.51) IDO1MAPTSMN1; SMN2MAOBEGFR
SCHEMBL7245463 0.83 MAOB (0.47) TP53MAPTSMN1; SMN2MAOBAHR
SCHEMBL6482150 0.81 CYP1A2 (0.49) IDO1MAPTSMN1; SMN2MAOBKDM4E

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-20050075332-A1 Tricyclic compounds with antiviral activity WARNER LAMBERT COMPANY 2005-04-07 US claimed
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-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 IDO1 1324/4885IGF1R 3806/4885TP53 2848/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 IDO1 671/4885IGF1R 2250/4885TP53 1970/4885

“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.