SCHEMBL3300405

SCHEMBL3300405

NC(=O)c1cc2c(N3CCNCC3)cccc2n1Cc1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.47
HTR6 P50406 10/20 0.45
DRD2 P14416 3/20 0.45
HTR1A P08908 3/20 0.45
HTR2A P28223 2/20 0.45
HTR7 P34969 2/20 0.45
PLA2G10 O15496 1/20 0.42
POLB P06746 1/20 0.40
IDO1 P14902 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
Hydrochloric Acid SCHEMBL3297632 0.99 F10 (0.46) F10HTR6DRD2HTR1AHTR2A
SCHEMBL3299174 0.91 HTR3A (0.47) F10HTR6DRD2HTR7
Hydrochloric Acid SCHEMBL3294093 0.90 HTR3A (0.46) F10HTR6DRD2HTR7
SCHEMBL3297730 0.89 HTR6 (0.56) F10HTR6HTR1AHTR2AHTR7
Hydrochloric Acid SCHEMBL3304362 0.89 HTR6 (0.55) F10HTR6HTR1AHTR2AHTR7
SCHEMBL3296433 0.88 HTR6 (0.60) F10HTR6DRD2HTR1AHTR2A
SCHEMBL3297950 0.87 F10 (0.45) F10HTR6DRD2HTR1AHTR2A
Hydrochloric Acid SCHEMBL3297278 0.87 HTR6 (0.59) F10HTR6DRD2HTR1AHTR2A
SCHEMBL3300925 0.84 HTR1A (0.44) HTR6DRD2HTR1AHTR2AHTR7
Hydrochloric Acid SCHEMBL3299238 0.83 HTR1A (0.43) HTR6DRD2HTR1AHTR2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2084131-A1 INDOLE AND BENZOFURAN 2-CARBOXAMIDE DERIVATIVES F. Hoffmann-Roche AG (CH) 2009-08-05 EP claimed
WO-2008055808-A1 INDOLE AND BENZOFURAN 2-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-05-15 WO claimed
US-7741326-B2 for enhancing cognitive memory in an Alzheimer's patient; 5-HT2-selective and 5-HT6 selective ligands ROCHE PALO ALTO LLC (US) 2010-06-22 US disclosed
US-7741326-B2 for enhancing cognitive memory in an Alzheimer's patient; 5-HT2-selective and 5-HT6 selective ligands ROCHE PALO ALTO LLC (US) 2010-06-22 US disclosed
US-7741326-B2 for enhancing cognitive memory in an Alzheimer's patient; 5-HT2-selective and 5-HT6 selective ligands ROCHE PALO ALTO LLC (US) 2010-06-22 US disclosed
US-20080146587-A1 Indole and benzofuran 2-carboxamide derivatives and uses thereof ROCHE PALO ALTO LLC 2008-06-19 US disclosed
US-20080146587-A1 Indole and benzofuran 2-carboxamide derivatives and uses thereof ROCHE PALO ALTO LLC 2008-06-19 US disclosed
US-20080146587-A1 Indole and benzofuran 2-carboxamide derivatives and uses thereof ROCHE PALO ALTO LLC 2008-06-19 US disclosed
WO-2008055808-A1 INDOLE AND BENZOFURAN 2-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-05-15 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-20080146587-A1 Indole and benzofuran 2-carboxamide derivatives and uses thereof AR, CNR2, CNR1 F10 2671/4885HTR6 49/4885DRD2 104/4885

“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.