SCHEMBL6842687

SCHEMBL6842687

CCC1OC(=O)N(Cc2ccc(NC(=O)c3ccncc3)cc2)N=C1c1ccc(OC)c(OCF)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAPK1 P28482 2/20 0.45
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PDE4D Q08499 6/20 0.42
PDE4A P27815 5/20 0.42
PDE4B Q07343 5/20 0.42
PDE4C Q08493 5/20 0.42
POLB P06746 2/20 0.42
NPC1 O15118 1/20 0.42
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NAMPT P43490 2/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL6841770 0.98 LMNA (0.46) LMNASMN1; SMN2MAPK1HTTL3MBTL1
SCHEMBL6687693 0.94 LMNA (0.46) LMNASMN1; SMN2MAPK1HTTL3MBTL1
SCHEMBL6689118 0.94 LMNA (0.51) LMNASMN1; SMN2MAPK1HTTL3MBTL1
SCHEMBL6691419 0.92 SMN1; SMN2 (0.46) LMNASMN1; SMN2MAPK1HTTL3MBTL1
SCHEMBL147782 0.92 NPC1 (0.42) LMNASMN1; SMN2MAPK1HTTPDE4D
SCHEMBL6683848 0.90 LMNA (0.44) LMNASMN1; SMN2MAPK1HTTL3MBTL1
SCHEMBL6683561 0.90 LMNA (0.44) LMNASMN1; SMN2MAPK1HTTL3MBTL1
SCHEMBL6662155 0.90 CCR5 (0.45) LMNASMN1; SMN2PDE4DPDE4APDE4B
SCHEMBL6654336 0.90 PDE4D (0.40) SMN1; SMN2PDE4DPDE4APDE4BPDE4C
SCHEMBL144599 0.90 ABCB1 (0.44) LMNASMN1; SMN2MAPK1HTTPDE4D

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 4 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-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 LMNA 2603/4885SMN1; SMN2 2642/4885MAPK1 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.