SCHEMBL13928815

SCHEMBL13928815

COc1cc2c(cc1NC(C)=O)CCN(C)CC2

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 2/20 0.53
▸ MAOB P27338 2/20 0.53
▸ SLC6A4 P31645 1/20 0.53
▸ LMNA P02545 4/20 0.48
▸ DRD2 P14416 1/20 0.48
▸ HTR2A P28223 1/20 0.48
▸ HTR2C P28335 1/20 0.48
▸ DRD3 P35462 1/20 0.48
▸ HTR6 P50406 1/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ DHODH Q02127 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ DRD1 P21728 1/20 0.47
▸ DRD4 P21917 1/20 0.47

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
SCHEMBL2785659 0.86 LMNA (0.60) LMNAMEN1KMT2ASMN1; SMN2HTT
SCHEMBL3440683 0.80 L3MBTL1 (0.47) MAOAMAOBSLC6A4SMN1; SMN2NPSR1
SCHEMBL11169272 0.76 MAOA (0.84) MAOAMAOBSLC6A4DRD2DRD3
SCHEMBL13928818 0.76 DRD2 (0.60) MAOAMAOBSLC6A4DRD2HTR2A
SCHEMBL29225656 0.75 HTR1A (0.47) LMNAHTR2AHTR2CHTR6MEN1
SCHEMBL7956482 0.75 MEN1 (0.65) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3503526 0.74 EGFR (0.61) HTR6KMT2AMAPTRAB9A
SCHEMBL12766942 0.74 HTR6 (0.57) HTR2AHTR2CHTR6KMT2AMAPT
Hydrochloric Acid SCHEMBL11158000 0.74 MAOA (0.81) MAOAMAOBSLC6A4DRD2DRD3
SCHEMBL26629784 0.74 MAOA (0.73) MAOAMAOBSLC6A4DRD2HTR2A

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-20090042862-A1 NOVEL COMPOUNDS BEST DESMOND JOHN 2009-02-12 — — US disclosed
US-7446103-B2 Bicyclic benzamide compound as histamine H3 receptor ligand useful in the treatment of neurological diseases GLAXO GROUP LIMITED (GB) 2008-11-04 — — US disclosed
US-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases GLAXO GROUP LIMITED (GB) 2007-05-10 — — US disclosed
US-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases GLAXO GROUP LIMITED (GB) 2007-05-10 — — 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-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases HRH3, HRH4, HRH1 MAOA 142/4885MAOB 201/4885SLC6A4 866/4885
US-20090042862-A1 NOVEL COMPOUNDS GRIN2C, GRIN2A, GRIN2B MAOA 44/4885MAOB 29/4885SLC6A4 139/4885

“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.

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