SCHEMBL3966003

SCHEMBL3966003

CNC(=O)CN1CC(CCN2CCN(c3ccc4[nH]ccc4c3)CC2)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.44
DRD2 P14416 8/20 0.39
DRD4 P21917 7/20 0.39
DRD3 P35462 5/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HTR1A P08908 1/20 0.38
HTR2A P28223 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL3965996 1.00 HTR7 (0.44) HTR7DRD2DRD4DRD3KDM4E
Oxalic Acid SCHEMBL27718856 0.98 HTR7 (0.42) HTR7DRD2DRD4DRD3KDM4E
Oxalic Acid SCHEMBL3964749 0.98 HTR7 (0.42) HTR7DRD2DRD4DRD3KDM4E
Oxalic Acid SCHEMBL3964740 0.98 HTR7 (0.42) HTR7DRD2DRD4DRD3KDM4E
SCHEMBL3956623 0.89 HTR7 (0.45) HTR7DRD2DRD4DRD3KDM4E
SCHEMBL3964456 0.89 HTR7 (0.45) HTR7DRD2DRD4DRD3KDM4E
SCHEMBL3956617 0.89 HTR7 (0.45) HTR7DRD2DRD4DRD3KDM4E
SCHEMBL3960224 0.88 HTR7 (0.44) HTR7DRD2DRD4DRD3KDM4E
SCHEMBL3960234 0.88 HTR7 (0.44) HTR7DRD2DRD4DRD3KDM4E
Hydrochloric Acid SCHEMBL3965460 0.88 HTR7 (0.45) HTR7DRD2DRD4DRD3KDM4E

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-7544685-B2 2,3-dihydroindole compounds H. LUNDBECK A/S (DK) 2009-06-09 US claimed
CN-101243075-A Novel 2,3-dihydroindole compounds LUNDBECK & CO AS H (DK) 2008-08-13 CN claimed
US-20070043058-A1 Novel 2,3-dihydroindole compounds H. LUNDBECK A/S (DK) 2007-02-22 US claimed
US-7544685-B2 2,3-dihydroindole compounds H. LUNDBECK A/S (DK) 2009-06-09 US disclosed
CN-101243075-A Novel 2,3-dihydroindole compounds LUNDBECK & CO AS H (DK) 2008-08-13 CN disclosed
US-20070043058-A1 Novel 2,3-dihydroindole compounds H. LUNDBECK A/S (DK) 2007-02-22 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 (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-20070043058-A1 Novel 2,3-dihydroindole compounds HTR2C, HTR2A, HTR5A HTR7 20/4885DRD2 24/4885DRD4 41/4885

“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.