SCHEMBL11986381

SCHEMBL11986381

[C-]#[N+]c1ccc2c(c1)[C@@H]1CNC[C@H]1CO2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.33
DRD2 P14416 8/20 0.32
DRD3 P35462 8/20 0.32

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
SCHEMBL990779 0.74 DRD2 (0.55) DRD2DRD3
SCHEMBL912111 0.74 DRD2 (0.55) DRD2DRD3
SCHEMBL7399742 0.74 DRD2 (0.55) DRD2DRD3
SCHEMBL8317912 0.74 DRD2 (0.53) HTR2CDRD2DRD3
SCHEMBL7847793 0.73 DRD2 (0.48) HTR2CDRD2DRD3
SCHEMBL7846708 0.73 DRD2 (0.48) HTR2CDRD2DRD3
SCHEMBL29960480 0.73 DRD2 (0.48) HTR2CDRD2DRD3
SCHEMBL7846711 0.73 DRD2 (0.48) HTR2CDRD2DRD3
SCHEMBL6245152 0.73 DRD2 (0.48) HTR2CDRD2DRD3
Hydrochloric Acid SCHEMBL8904853 0.73 DRD2 (0.52) HTR2CDRD2DRD3

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-8247441-B2 Chromene compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2012-08-21 US disclosed
US-20110021490-A1 Chromene compounds, a process for their preparationand pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-01-27 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-20110021490-A1 Chromene compounds, a process for their preparationand pharmaceutical compositions containing them CHRM3, CCKAR, ADRB3 HTR2C 102/4885DRD2 239/4885DRD3 51/4885

“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.