SCHEMBL3538167

SCHEMBL3538167

CN(C)C1CCN(C(=O)c2ccc3c(c2)cc(C(=O)N2CCC(F)(F)CC2)n3-c2cccc(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 11/20 0.51
HRH3 Q9Y5N1 2/20 0.49
L3MBTL3 Q96JM7 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
F10 P00742 1/20 0.40
HSD11B1 P28845 1/20 0.40
MGLL Q99685 1/20 0.40
HTR1A P08908 1/20 0.40
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL3538225 0.96 HPGD (0.49) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3541051 0.91 HRH3 (0.50) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3537669 0.90 HRH3 (0.44) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3537316 0.88 HRH3 (0.43) HPGDHRH3L3MBTL3CYP2D6ALDH1A1
SCHEMBL3537002 0.86 HPGD (0.51) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3541263 0.86 PDK2 (0.46) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3537097 0.85 HPGD (0.51) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3542678 0.85 L3MBTL1 (0.54) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3535868 0.85 HPGD (0.52) HPGDHRH3L3MBTL3MEN1KMT2A
SCHEMBL3539588 0.85 HRH3 (0.46) HPGDHRH3L3MBTL3HSD11B1MGLL

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-7723325-B2 5-amido-indole-2-carboxamide derivatives HOFFMAN-LA ROCHE INC. (US) 2010-05-25 US disclosed
US-20090264418-A1 5-AMIDO-INDOLE-2-CARBOXAMIDE DERIVATIVES NETTEKOVEN MATTHIAS 2009-10-22 US disclosed
US-7601711-B2 Such as [5-(4-cyclopentyl-piperazine-1-carbonyl)-1H-indol-2-yl]-morpholin-4-yl-methanone; histamine H3-antagonists HOFFMANN-LA ROCHE INC. (US) 2009-10-13 US disclosed
EP-2010487-A1 5-AMIDO-2-CARBOXAMIDE INDOLES F. Hoffmann-Roche AG (CH) 2009-01-07 EP disclosed
WO-2007115938-A1 5-AMIDO-2-CARBOXAMIDE INDOLES F. HOFFMANN-LA ROCHE AG (CH) 2007-10-18 WO disclosed
US-20070244125-A1 5-amido-indole-2-carboxamide derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-10-18 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 (2 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-20090264418-A1 5-AMIDO-INDOLE-2-CARBOXAMIDE DERIVATIVES HRH4, HRH3, CNR2 HPGD 810/4885HRH3 2/4885L3MBTL3 3467/4885
US-20070244125-A1 5-amido-indole-2-carboxamide derivatives HRH4, HRH3, CNR2 HPGD 810/4885HRH3 2/4885L3MBTL3 3467/4885

“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.