SCHEMBL5024914

SCHEMBL5024914

COc1cc(C(=O)Cl)cc(OC)c1OC1CCCC1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.63
PDE4B Q07343 12/20 0.47
PDE4D Q08499 12/20 0.47
MAPK14 Q16539 1/20 0.47
PDE4A P27815 11/20 0.47
PDE4C Q08493 11/20 0.47
TDP1 Q9NUW8 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL71331 0.82 PDE4D (0.65) PDE4BPDE4DMAPK14PDE4APDE4C
SCHEMBL7336558 0.81 PDE4D (0.64) PDE4BPDE4DMAPK14PDE4APDE4C
SCHEMBL1457706 0.80 KMT2A (0.73) KMT2APDE4BPDE4DMAPK14PDE4A
SCHEMBL28275397 0.77 TUBB4A (0.55) KMT2A
SCHEMBL219096 0.77 TUBB4A (0.55) KMT2A
SCHEMBL7356246 0.76 PDE4D (0.46) KMT2APDE4BPDE4DMAPK14PDE4A
SCHEMBL14218378 0.75 TPMT (0.47) KMT2APOLB
SCHEMBL7462332 0.74 KMT2A (0.51) KMT2APDE4BPDE4DPDE4APDE4C
SCHEMBL7418490 0.74 PDE4B (0.49) PDE4BPDE4DMAPK14PDE4APDE4C
Tetrahydrofuran SCHEMBL28731511 0.73 MAPT (0.53) KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419138-B1 N- (1-DIMETHYLAMINOCYCLOALKYL)METHYL BENZAMIDE DERIVATIVES ORGANON NV (NL) 2008-10-29 EP disclosed
US-7126027-B2 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives AKZO NOBEL N.V. (NL) 2006-10-24 US disclosed
US-20040242685-A1 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives N.V. ORGANON (NL) 2004-12-02 US disclosed
EP-1419138-A1 N- (1-DIMETHYLAMINOCYCLOALKYL)METHYL]BENZAMIDE DERIVATIVES Akzo Nobel (NL) 2004-05-19 EP disclosed
WO-2003010132-A1 N-[(1-DIMETHYLAMINOCYCLOALKYL)METHYL]BENZAMIDE DERIVATIVES AKZO NOBEL N.V. (NL) 2003-02-06 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-20040242685-A1 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives SLC1A2, SLC6A1, KCNT2 KMT2A 288/4885PDE4B 3176/4885PDE4D 3197/4885

“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.