SCHEMBL6774357

SCHEMBL6774357

COc1ccc(OC)c(CNc2cc3c(cc2OC)oc2ccccc23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.56
HPGD P15428 8/20 0.56
MAPT P10636 8/20 0.56
KDM4E B2RXH2 7/20 0.56
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
RAB9A P51151 3/20 0.56
GAA P10253 1/20 0.56
ALOX15 P16050 1/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
ACHE P22303 1/20 0.54
NPSR1 Q6W5P4 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
SCHEMBL6483874 0.88 HPGD (0.63) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL6496536 0.85 HIF1A (0.55) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL6483561 0.84 HDAC8 (0.55) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL6769338 0.82 ACHE (0.58) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL6498108 0.75 DHFR (0.54) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL7503353 0.75 ALDH1A1 (0.60) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL12542220 0.73 MAPT (0.70) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL5540590 0.72 HIF1A (0.56) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL27907643 0.72 HIF1A (0.56) ALDH1A1HPGDMAPTKDM4EMEN1
SCHEMBL6768170 0.72 MEN1 (0.59) MAPTMEN1KMT2ALMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ALDH1A1 4486/4885HPGD 3199/4885MAPT 2337/4885

“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.