SCHEMBL6484478

SCHEMBL6484478

Clc1ccc2oc3ccc(NCc4ccccn4)cc3c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
KDM4E B2RXH2 6/20 0.54
HPGD P15428 4/20 0.54
MAOA P21397 3/20 0.50
MAOB P27338 3/20 0.50
RAB9A P51151 7/20 0.49
KMT2A Q03164 4/20 0.49
MAPT P10636 4/20 0.49
MEN1 O00255 3/20 0.49
GAA P10253 3/20 0.49
ALOX15 P16050 2/20 0.49
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 5/20 0.49
CYP1A2 P05177 3/20 0.49
CYP3A4 P08684 3/20 0.49
CYP2C19 P33261 2/20 0.49
PTPN11 Q06124 1/20 0.49
CYP2C9 P11712 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.45
MAP3K8 P41279 1/20 0.45

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
SCHEMBL6482209 0.88 KDM4E (0.61) ALDH1A1KDM4EHPGDMAOAMAOB
SCHEMBL6485053 0.86 RAB9A (0.53) ALDH1A1KDM4EHPGDMAOAMAOB
SCHEMBL6495066 0.85 MAOA (0.50) ALDH1A1KDM4EHPGDMAOAMAOB
SCHEMBL6495487 0.80 MAOB (0.49) ALDH1A1KDM4EHPGDMAOBKMT2A
SCHEMBL6482111 0.79 MAOA (0.40) ALDH1A1KDM4EHPGDMAOAMAOB
SCHEMBL10557233 0.79 MAOA (0.73) ALDH1A1KDM4EHPGDMAOAMAOB
SCHEMBL3952305 0.78 MAOA (0.67) ALDH1A1KDM4EHPGDMAOAMAOB
SCHEMBL6482868 0.77 ALDH1A1 (0.48) ALDH1A1KDM4EMAPTGAAHSD17B10
SCHEMBL6498055 0.76 MAPT (0.56) ALDH1A1KDM4EHPGDRAB9AKMT2A
SCHEMBL6483203 0.76 TRPM5 (0.48) ALDH1A1KDM4ERAB9AKMT2AMAPT

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 ALDH1A1 4486/4885KDM4E 1279/4885HPGD 3199/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 ALDH1A1 4111/4885KDM4E 1476/4885HPGD 4074/4885

“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.