SCHEMBL14737018

SCHEMBL14737018

NS(=O)(=O)c1ccc(COc2c(-c3ccc4c(c3)COC4=O)ccc(OC(F)F)c2O)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOA P21397 10/20 0.44
MAOB P27338 10/20 0.44
PRF1 P14222 6/20 0.41
ACHE P22303 1/20 0.37
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34

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
SCHEMBL2592339 0.91 MAOA (0.44) MAOAMAOBPRF1ACHE
SCHEMBL7716256 0.89 MAOA (0.43) MAOAMAOBPRF1ACHECA12
SCHEMBL7712590 0.87 MAOA (0.43) MAOAMAOBPRF1
SCHEMBL14737209 0.81 PRF1 (0.47) MAOAMAOBPRF1ACHECA12
SCHEMBL14737565 0.81 MAOA (0.45) MAOAMAOBPRF1CA12CA1
SCHEMBL14749575 0.81 MAOA (0.44) MAOAMAOBPRF1ACHE
SCHEMBL2588544 0.79 MAOA (0.44) MAOAMAOBPRF1
SCHEMBL7713161 0.75 PRF1 (0.46) MAOAMAOBPRF1
SCHEMBL2594294 0.73 AKT1 (0.36) CA12CA1CA2CA4CA7
SCHEMBL2589783 0.73 MAOA (0.46) MAOAMAOBPRF1ACHE

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
EP-2563770-B1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2016-03-23 EP claimed
US-9051290-B2 Biaryl phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-06-09 US claimed
US-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-03-07 US claimed
EP-2563770-B1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2016-03-23 EP disclosed
US-9051290-B2 Biaryl phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-06-09 US disclosed
US-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-03-07 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-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS PDE3B, PDE3A, PDE4A MAOA 191/4885MAOB 223/4885PRF1 3550/4885

“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.