SCHEMBL3203133

SCHEMBL3203133

NC(=O)CCCN1CCN(c2nc3ccccc3[nH]2)CC1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.55
DRD4 P21917 1/20 0.55
DRD3 P35462 1/20 0.55
BCHE P06276 1/20 0.53
ACHE P22303 1/20 0.53
HTR3A P46098 1/20 0.52
HTR2B P41595 1/20 0.52
TP53 P04637 2/20 0.51
MAPT P10636 2/20 0.50
SORD Q00796 1/20 0.50
RAB9A P51151 1/20 0.50
LMNA P02545 2/20 0.49
TRPC3 Q13507 1/20 0.49
KCNH2 Q12809 1/20 0.47
HDAC11 Q96DB2 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL3203149 0.84 BCHE (0.57) DRD2DRD4DRD3BCHEACHE
SCHEMBL7534372 0.82 BCHE (0.58) DRD2DRD4DRD3BCHEACHE
SCHEMBL4704809 0.77 TRPC3 (0.60) BCHEACHEHTR3AHTR2BTP53
SCHEMBL10247572 0.76 ACHE (0.65) DRD4BCHEACHEHTR3AHTR2B
SCHEMBL7841229 0.76 BCHE (0.57) DRD4BCHEACHEHTR3AHTR2B
SCHEMBL2879692 0.75 DPP4 (0.51) DRD2DRD4DRD3BCHEACHE
SCHEMBL27617582 0.75 DPP4 (0.51) DRD2DRD4DRD3BCHEACHE
Hydrochloric Acid SCHEMBL7215392 0.75 BCHE (0.56) DRD4BCHEACHEHTR3ATP53
SCHEMBL12076080 0.74 TP53 (0.65) BCHEACHEHTR3ATP53MAPT
SCHEMBL5309716 0.74 BCHE (0.71) BCHEACHEHTR3AHTR2BTP53

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 1 patent. 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

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 DRD2 13/4885DRD4 26/4885DRD3 1/4885

“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.