SCHEMBL3205704

SCHEMBL3205704

NCCCCN1CCN(c2cccc(C(N)=O)c2)CC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.62
CYP2D6 P10635 1/20 0.56
HTR1A P08908 4/20 0.56
DRD2 P14416 3/20 0.56
HTR2A P28223 3/20 0.56
HTR6 P50406 1/20 0.56
KCNH2 Q12809 2/20 0.56
FAAH O00519 3/20 0.54
DRD3 P35462 3/20 0.54

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
SCHEMBL4515283 0.91 KDM4E (0.58) HTR7CYP2D6HTR1ADRD2HTR2A
SCHEMBL3205692 0.88 HTR7 (0.63) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL3187817 0.86 HTR7 (0.63) HTR7CYP2D6HTR1ADRD2HTR2A
SCHEMBL3198767 0.86 DRD2 (0.52) HTR7CYP2D6HTR1ADRD2HTR2A
SCHEMBL3230486 0.85 HTR7 (0.59) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL3189302 0.84 KCNH2 (0.51) HTR7CYP2D6DRD2KCNH2DRD3
SCHEMBL3187228 0.82 DRD2 (0.67) HTR7CYP2D6DRD2KCNH2DRD3
SCHEMBL3187894 0.82 KCNH2 (0.83) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL3194787 0.81 CYP2D6 (0.64) HTR7CYP2D6HTR1ADRD2HTR2A
Hydrochloric Acid SCHEMBL3196389 0.81 OPRM1 (0.65) HTR7CYP2D6DRD2KCNH2DRD3

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-20100029682-A1 NOVEL CHROMENE AND THIOCHROMENE CARBOXAMIDE DERIVATIVES, METHODS FOR PREPARING SAME AND THERAPEUTIC APPLICATIONS OF SAME PIERRE FABRE MEDICAMENT (FR) 2010-02-04 US claimed
US-20100029682-A1 NOVEL CHROMENE AND THIOCHROMENE CARBOXAMIDE DERIVATIVES, METHODS FOR PREPARING SAME AND THERAPEUTIC APPLICATIONS OF SAME PIERRE FABRE MEDICAMENT (FR) 2010-02-04 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-20100029682-A1 NOVEL CHROMENE AND THIOCHROMENE CARBOXAMIDE DERIVATIVES, METHODS FOR PREPARING SAME AND THERAPEUTIC APPLICATIONS OF SAME DRD3, CHRNA3, CHRM3 HTR7 119/4885CYP2D6 896/4885HTR1A 66/4885

“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.