SCHEMBL3536760

SCHEMBL3536760

O=C(c1ccc2c(c1)cc(C(=O)N1CCC(F)(F)CC1)n2-c1ccc(Cl)nc1)N1CCC(N2CCCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 12/20 0.48
L3MBTL1 Q9Y468 11/20 0.48
HRH3 Q9Y5N1 2/20 0.45
ADRA1A P35348 2/20 0.45
MBTD1 Q05BQ5 5/20 0.45
TP53BP1 Q12888 3/20 0.45
L3MBTL4 Q8NA19 2/20 0.45
LRRK2 Q5S007 1/20 0.43
HPGD P15428 1/20 0.42
LMNA P02545 1/20 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
SCHEMBL3538564 0.99 L3MBTL3 (0.47) L3MBTL3L3MBTL1HRH3ADRA1AMBTD1
SCHEMBL3537218 0.94 HRH3 (0.50) L3MBTL3L3MBTL1HRH3ADRA1ALRRK2
SCHEMBL3539302 0.94 HRH3 (0.48) L3MBTL3L3MBTL1HRH3ADRA1ALRRK2
SCHEMBL3537803 0.89 L3MBTL3 (0.48) L3MBTL3L3MBTL1HRH3ADRA1AMBTD1
SCHEMBL3540716 0.88 L3MBTL3 (0.47) L3MBTL3L3MBTL1HRH3ADRA1AMBTD1
SCHEMBL3537002 0.86 HPGD (0.51) L3MBTL3L3MBTL1HRH3MBTD1TP53BP1
SCHEMBL3537097 0.85 HPGD (0.51) L3MBTL3L3MBTL1HRH3MBTD1LRRK2
SCHEMBL3539595 0.83 HRH3 (0.51) L3MBTL3L3MBTL1HRH3HPGD
SCHEMBL3536426 0.83 HRH3 (0.54) L3MBTL3L3MBTL1HRH3HPGDLMNA
SCHEMBL3539281 0.83 HRH3 (0.50) L3MBTL3L3MBTL1HRH3ADRA1AHPGD

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 L3MBTL3 3467/4885L3MBTL1 3202/4885HRH3 2/4885
US-20070244125-A1 5-amido-indole-2-carboxamide derivatives HRH4, HRH3, CNR2 L3MBTL3 3467/4885L3MBTL1 3202/4885HRH3 2/4885

“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.