SCHEMBL6660414

SCHEMBL6660414

CCC1CC(=O)N(Cc2ccc(NC(=O)c3ccccn3)cc2)N=C1c1ccc(OC)c(OC2CCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.53
PDE4B Q07343 15/20 0.53
PDE4A P27815 15/20 0.53
PDE4C Q08493 14/20 0.53
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GRM4 Q14833 2/20 0.41

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
SCHEMBL6657023 0.94 PDE4D (0.53) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6660427 0.93 PDE4D (0.52) PDE4DPDE4BPDE4APDE4C
SCHEMBL6656461 0.93 SMN1; SMN2 (0.52) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6662113 0.92 PDE4A (0.49) PDE4DPDE4BPDE4APDE4CNPC1
SCHEMBL6659044 0.90 SMN1; SMN2 (0.48) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6676111 0.89 PDE4A (0.50) PDE4DPDE4BPDE4APDE4CSMN1; SMN2
SCHEMBL6654138 0.89 NPC1 (0.46) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6660436 0.89 SMN1; SMN2 (0.46) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6654578 0.89 SMN1; SMN2 (0.48) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6657825 0.89 AURKB (0.47) PDE4DPDE4BPDE4APDE4CKDM4E

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
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
US-5859008-A Arylalkyl diazinones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-01-12 US 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 PDE4D 12/4885PDE4B 4/4885PDE4A 1/4885

“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.