SCHEMBL6677546

SCHEMBL6677546

CCC1CC(=O)N(Cc2ccc(NC(=O)c3ccno3)cc2)N=C1c1ccc(OC)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.40
PDE4D Q08499 9/20 0.40
PDE4B Q07343 8/20 0.40
PDE4A P27815 6/20 0.40
PDE4C Q08493 6/20 0.40
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
MAPK14 Q16539 1/20 0.37
HTR2A P28223 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL6679903 0.94 PDE4D (0.46) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6678984 0.92 PDE4D (0.42) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6675637 0.92 PDE4D (0.42) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6675315 0.92 PDE4D (0.42) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6682550 0.91 PDE4D (0.41) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6677873 0.90 PDE4D (0.41) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6679918 0.90 PDE4D (0.41) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6676281 0.90 PDE4D (0.41) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6678402 0.90 PDE4D (0.41) MEN1KMT2AMAPK1PDE4DPDE4B
SCHEMBL6675734 0.89 PDE4A (0.49) PDE4DPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235845-A1 Use of phosphodiesterase iv inhibitors MERCK PATENT GESSELSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2004-11-25 US disclosed
EP-1435958-A1 USE OF PHOSPHORODIESTERASE IV INHIBITORS MERCK PATENT GmbH (DE) 2004-07-14 EP disclosed
WO-2003032993-A1 USE OF PHOSPHORODIESTERASE IV INHIBITORS MERCK PATENT GMBH (DE) 2003-04-24 WO disclosed
EP-0763534-B1 Arylalkyl-diazinone derivatives as phosphodiesterase IV inhibitors MERCK PATENT GMBH (DE) 2003-02-26 EP disclosed
EP-0977756-A1 PYRAZOLOPYRIMIDINONES WHICH INHIBIT TYPE 5 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE (cGMP PDE5) FOR THE TREATMENT OF SEXUAL DYSFUNCTION Pfizer Limited (GB) 2000-02-09 EP disclosed
US-5859008-A Arylalkyl diazinones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-01-12 US disclosed
WO-1998049166-A1 PYRAZOLOPYRIMIDINONES WHICH INHIBIT TYPE 5 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE (cGMP PDE5) FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 1998-11-05 WO disclosed
EP-0763534-A1 Arylalkyl-diazinone derivatives as phosphodiesterase IV inhibitors MERCK PATENT GmbH (DE) 1997-03-19 EP 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-20040235845-A1 Use of phosphodiesterase iv inhibitors PDE4A, PDE3A, PDE3B MEN1 370/4885KMT2A 3056/4885MAPK1 1267/4885

“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.