SCHEMBL13533347

SCHEMBL13533347

Oc1cccc2c1C[C@H](N1CCNCC1)CC2

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.66
CHRM3 P20309 2/20 0.48
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
HTR1A P08908 3/20 0.43
HTR1D P28221 3/20 0.43
DRD2 P14416 2/20 0.43
DRD3 P35462 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
HTR2B P41595 1/20 0.43
HTR5A P47898 1/20 0.43
BLM P54132 1/20 0.42

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
SCHEMBL13533345 1.00 HTR7 (0.66) HTR7CHRM3CHRM2CHRM1HTR1A
SCHEMBL9727223 0.87 HTR7 (0.71) HTR7CHRM3CHRM2CHRM1HTR1A
SCHEMBL7932835 0.85 HTR7 (0.69) HTR7CHRM3CHRM2CHRM1HTR1A
SCHEMBL11072209 0.85 HTR7 (0.69) HTR7CHRM3CHRM2CHRM1HTR1A
Hydrochloric Acid SCHEMBL7926756 0.84 HTR7 (0.67) HTR7CHRM3CHRM2CHRM1HTR1A
SCHEMBL13533343 0.83 HTR7 (0.70) HTR7CHRM3CHRM2CHRM1HTR1A
SCHEMBL13533346 0.83 HTR7 (0.70) HTR7CHRM3CHRM2CHRM1HTR1A
SCHEMBL9345138 0.83 OPRM1 (0.55) HTR7HTR1DDRD2DRD3CYP2D6
Hydrochloric Acid SCHEMBL9341244 0.80 HTR2C (0.50) CHRM3CHRM2CHRM1HTR1AHTR2A
SCHEMBL9342090 0.80 HTR1A (0.47) HTR7HTR1AHTR1DHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 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-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS HTR6, GAP43, HTR5A HTR7 11/4885CHRM3 231/4885CHRM2 257/4885

“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.