SCHEMBL6490342

SCHEMBL6490342

COc1cc(CNc2ccc3oc4ccccc4c3c2)cc(OC)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.51
DHFR P00374 1/20 0.50
CNR2 P34972 4/20 0.46
MAOA P21397 1/20 0.45
HPGD P15428 6/20 0.44
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
ALDH1A1 P00352 5/20 0.44
MAPT P10636 5/20 0.44
KDM4E B2RXH2 4/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RAB9A P51151 3/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL6493255 0.90 MAPT (0.55) HIF1ACNR2MAOAHPGDMEN1
SCHEMBL6483334 0.90 CNR2 (0.56) HIF1ACNR2MAOAHPGDMEN1
SCHEMBL6494943 0.88 DHFR (0.51) HIF1ADHFRCNR2MEN1KMT2A
SCHEMBL6769992 0.86 DHFR (0.49) HIF1ADHFRCNR2MEN1KMT2A
SCHEMBL6765296 0.86 DHFR (0.49) HIF1ADHFRMEN1KMT2AALDH1A1
SCHEMBL6484790 0.83 MAPT (0.57) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL7246584 0.82 CYP1A2 (0.53) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL6482295 0.82 HPGD (0.54) DHFRMAOAHPGDMEN1KMT2A
SCHEMBL6496536 0.80 HIF1A (0.55) HIF1ADHFRMAOAHPGDMEN1
SCHEMBL6498108 0.80 DHFR (0.54) DHFRMAOAHPGDMEN1KMT2A

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 6 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
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

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 HIF1A 3185/4885DHFR 666/4885CNR2 1010/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 HIF1A 1519/4885DHFR 431/4885CNR2 1646/4885

“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.