SCHEMBL6481093

SCHEMBL6481093

CN(C)c1ccc(CNc2ccc3oc4ccccc4c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPT P10636 6/20 0.45
KMT2A Q03164 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
GFER P55789 2/20 0.45
CA9 Q16790 2/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 3/20 0.44
TP53 P04637 2/20 0.44
MAOB P27338 2/20 0.42
NOS1 P29475 1/20 0.42
TNKS O95271 1/20 0.42
CYP1A2 P05177 3/20 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
SCHEMBL6768807 0.86 ALDH1A1 (0.44) ELANEALDH1A1MAPTKMT2ATDP1
SCHEMBL6493319 0.85 HTT (0.53) ALDH1A1MAPTKMT2ALMNAHTT
SCHEMBL6482295 0.84 HPGD (0.54) ALDH1A1MAPTKMT2ALMNAHTT
SCHEMBL7246584 0.84 CYP1A2 (0.53) ALDH1A1MAPTKMT2ATDP1LMNA
SCHEMBL6493823 0.82 EGFR (0.50) ALDH1A1MAPTKMT2ATDP1HTT
SCHEMBL7245463 0.82 MAOB (0.47) ALDH1A1MAPTKMT2ATDP1LMNA
SCHEMBL6480348 0.82 MEN1 (0.56) ALDH1A1MAPTKMT2ATDP1LMNA
SCHEMBL6483334 0.82 CNR2 (0.56) ALDH1A1MAPTKMT2ATDP1LMNA
SCHEMBL6484020 0.82 CA1 (0.45) ALDH1A1MAPTKMT2ATDP1LMNA
SCHEMBL6491860 0.80 KDM4E (0.49) ALDH1A1MAPTKMT2ATDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256164-A1 NK1 and NK3 antagonists PFIZER INC 2005-11-17 US claimed
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-20050256164-A1 NK1 and NK3 antagonists PFIZER INC 2005-11-17 US disclosed
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 (3 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 ELANE 2920/4885ALDH1A1 4486/4885MAPT 2337/4885
US-20050256164-A1 NK1 and NK3 antagonists TAC3, TACR1, TACR2 ELANE 695/4885ALDH1A1 3567/4885MAPT 2851/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 ELANE 2226/4885ALDH1A1 4111/4885MAPT 3500/4885

“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.