SCHEMBL3975337

SCHEMBL3975337

O=C(NCCCCN1CCN(c2ccc(Cl)cc2)CC1)C1=Cc2ccccc2SC1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.64
DRD4 P21917 12/20 0.64
DRD3 P35462 3/20 0.58
ADRA1A P35348 1/20 0.58
SLC6A4 P31645 3/20 0.54
SLC6A2 P23975 1/20 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
SCHEMBL3983538 0.92 DRD2 (0.59) DRD2DRD4DRD3ADRA1ASLC6A4
SCHEMBL8223555 0.91 DRD3 (0.55) DRD2DRD4DRD3ADRA1ASLC6A4
SCHEMBL8231965 0.88 DRD4 (0.57) DRD2DRD4DRD3SLC6A4SLC6A2
SCHEMBL3977153 0.88 DRD3 (0.55) DRD2DRD4DRD3ADRA1A
SCHEMBL3977020 0.88 DRD3 (0.61) DRD2DRD4DRD3ADRA1A
SCHEMBL3982334 0.87 DRD2 (0.59) DRD2DRD4DRD3ADRA1ASLC6A4
SCHEMBL13484970 0.87 DRD3 (0.47) DRD2DRD4DRD3ADRA1ASLC6A4
SCHEMBL3982327 0.85 DRD3 (0.60) DRD2DRD4DRD3ADRA1A
SCHEMBL3976554 0.84 DRD3 (0.58) DRD2DRD4DRD3ADRA1A
SCHEMBL3981916 0.84 DRD3 (0.66) DRD2DRD4DRD3ADRA1ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057138-A1 NOVEL CHROMENE AND THIOCHROMENE CARBOXAMIDE DERIVATIVES, METHODS FOR PREPARING SAME AND THERAPEUTIC APPLICATIONS OF SAME Pierre Fabre Medicament (FR) 2009-05-13 EP claimed
WO-2008009741-A1 NOVEL CHROMENE AND THIOCHROMENE CARBOXAMIDE DERIVATIVES, METHODS FOR PREPARING SAME AND THERAPEUTIC APPLICATIONS OF SAME PIERRE FABRE MEDICAMENT (FR) 2008-01-24 WO 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
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 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.