SCHEMBL4060132

SCHEMBL4060132

Brc1ccc(OCc2cccnc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.56
CYP19A1 P11511 1/20 0.50
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
APP P05067 1/20 0.50
MAOA P21397 2/20 0.49
DYRK1A Q13627 1/20 0.49
GPR132 Q9UNW8 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HTR1A P08908 1/20 0.48
DRD2 P14416 1/20 0.48
RAB9A P51151 1/20 0.47
ACACB O00763 1/20 0.46
KDM1A O60341 1/20 0.46

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
SCHEMBL28048524 0.91 MAPK1 (0.64) MAPK1CYP19A1CYP11B1CYP11B2MAOA
SCHEMBL7311175 0.84 MAPK1 (0.65) MAPK1GPR132MEN1KMT2AHTR1A
SCHEMBL171895 0.83 MAPK1 (0.56) MAPK1CYP19A1CYP11B1CYP11B2MAOA
SCHEMBL8881389 0.83 HTT (0.62) MAPK1CYP19A1CYP11B1CYP11B2APP
SCHEMBL30896277 0.83 RAB9A (0.61) MAPK1APPMAOARAB9AHTT
SCHEMBL24932986 0.83 RAB9A (0.61) MAPK1APPMAOARAB9AHTT
SCHEMBL3761776 0.83 MAOB (0.62) MAPK1CYP19A1CYP11B1CYP11B2APP
SCHEMBL8361615 0.83 MAPK1 (0.56) MAPK1CYP19A1CYP11B1CYP11B2APP
SCHEMBL8041706 0.83 MAPK1 (0.56) MAPK1CYP19A1CYP11B1CYP11B2MAOA
SCHEMBL30354931 0.83 MAOB (0.62) MAPK1CYP19A1CYP11B1CYP11B2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
EP-1560834-B1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL LAB (ES) 2008-06-25 EP disclosed
EP-1560834-B1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL LAB (ES) 2008-06-25 EP disclosed
US-20060116363-A1 Tricyclic derivatives as ltd4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2006-06-01 US disclosed
EP-1560834-A1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS Almirall Prodesfarma, S.A. (ES) 2005-08-10 EP disclosed
WO-2004043966-A1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL PRODESFARMA S.A. (ES) 2004-05-27 WO disclosed
WO-2003033467-A1 NITROSO DIPHENYLAMINE DERIVATIVES AS NITROGEN MONOXIDE GENERATING AGENTS MERCK PATENT GMBH (DE) 2003-04-24 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-20060116363-A1 Tricyclic derivatives as ltd4 antagonists LTA4H, LTC4S, LTB4R2 MAPK1 1947/4885CYP19A1 1505/4885CYP11B1 1273/4885

“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.