SCHEMBL7246016

SCHEMBL7246016

O=C1c2cc(Br)ccc2COc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
MAPT P10636 4/20 0.57
ALDH1A1 P00352 3/20 0.57
RAB9A P51151 2/20 0.57
PKM P14618 1/20 0.51
TSHR P16473 1/20 0.51
APP P05067 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
GAA P10253 1/20 0.50
HPGD P15428 1/20 0.50
ALOX12 P18054 1/20 0.50
MAOB P27338 2/20 0.49
MAOA P21397 1/20 0.49
AKR1B1 P15121 1/20 0.47
MAPK14 Q16539 3/20 0.46
PTPRC P08575 1/20 0.46
HTR2B P41595 1/20 0.44

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
SCHEMBL3142640 0.89 MAPT (0.72) TDP1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL9129183 0.89 MAPT (0.58) TDP1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL1918267 0.88 MAPK14 (0.55) TDP1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL30838899 0.87 TDP1 (0.49) TDP1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL490119 0.86 AKR1B1 (0.58) TDP1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL86392 0.83 MAPT (0.67) TDP1MAPTALDH1A1RAB9APKM
SCHEMBL29375440 0.83 MAPT (0.67) TDP1MAPTALDH1A1RAB9APKM
SCHEMBL11575984 0.81 MAPK14 (0.60) TDP1MAPTALDH1A1RAB9APKM
SCHEMBL10922670 0.81 ALDH1A1 (0.54) TDP1MAPTALDH1A1RAB9APKM
SCHEMBL10917991 0.81 AKR1B1 (0.53) TDP1MAPTALDH1A1RAB9APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0069810-B1 NOVEL DIBENZOXEPINS, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THE USE OF DIBENZOXEPINS IN THE TREATMENT OF ALLERGIC CONDITIONS MERCK & CO. INC. (US) 1986-12-03 EP claimed
EP-0069810-A1 Novel dibenzoxepins, their preparation, compositions containing them and the use of dibenzoxepins in the treatment of allergic conditions MERCK & CO. INC. (US) 1983-01-19 EP claimed
US-20030216571-A1 Antiallergens; antiinflammatory agents UBE INDUSTRIES, LTD. (JP) 2003-11-20 US disclosed
EP-1254897-A1 TRICYCLIC COMPOUNDS Ube Industries, Ltd. (JP) 2002-11-06 EP disclosed
EP-0351887-B1 Tricyclic aromatic compounds WELLCOME FOUND (GB) 1995-07-26 EP disclosed
US-5395610-A Agents for potentiating the effects of antitumor agents and combating multiple drug resistance BURROUGHS-WELLCOME CO. (US) 1995-03-07 US disclosed
US-5300282-A Agents for potentiating the effects of antitumor agents and combating multiple drug resistance BURROUGHS-WELLCOME COMPANY (US) 1994-04-05 US disclosed
EP-0409406-B1 ARYL-SUBSTITUTED AMINE DERIVATIVES USEFUL IN CANCER THERAPY THE WELLCOME FOUNDATION LIMITED (GB) 1993-09-08 EP disclosed
EP-0487502-A2 Pharmaceutically active aryl-substituted amine derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1992-05-27 EP disclosed
EP-0409406-A2 Aryl-substituted amine derivatives useful in cancer therapy THE WELLCOME FOUNDATION LIMITED (GB) 1991-01-23 EP disclosed
WO-1990015599-A1 MEDICAMENTS USEFUL IN CANCER THERAPY AND HAVING ANTIHISTAMINIC PROPERTIES THE WELLCOME FOUNDATION LIMITED (GB) 1990-12-27 WO disclosed
US-4923892-A DOXEPIN DERIVATIVES; ANTIALLERGENS, ANTIASTHMATICS, ANTIHISTAMINES BURROUGHS WELLCOME CO. (US) 1990-05-08 US disclosed
EP-0214779-B1 TRICYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1990-04-11 EP disclosed
EP-0351887-A1 Tricyclic aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1990-01-24 EP disclosed
US-4871865-A ANTIHISTAMINES BURROUGHS WELLCOME CO. (US) 1989-10-03 US disclosed
EP-0316022-A2 Tricyclic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1989-05-17 EP disclosed
EP-0214779-A1 Tricyclic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1987-03-18 EP disclosed
EP-0069810-B1 NOVEL DIBENZOXEPINS, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THE USE OF DIBENZOXEPINS IN THE TREATMENT OF ALLERGIC CONDITIONS MERCK & CO. INC. (US) 1986-12-03 EP disclosed
EP-0069810-A1 Novel dibenzoxepins, their preparation, compositions containing them and the use of dibenzoxepins in the treatment of allergic conditions MERCK & CO. INC. (US) 1983-01-19 EP disclosed
US-4282365-A Dibenz[b,e]oxepin compounds MERCK & CO., INC. (US) 1981-08-04 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 (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-20030216571-A1 Antiallergens; antiinflammatory agents CYSLTR2, CYSLTR1, LTC4S TDP1 3993/4885L3MBTL1 1403/4885MAPT 4812/4885

“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.