SCHEMBL3200010

SCHEMBL3200010

NC(=O)CCCN1CCN(c2ccc(Cl)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 3/20 0.69
DRD4 P21917 11/20 0.66
DRD2 P14416 11/20 0.66
HTR1A P08908 4/20 0.66
DRD3 P35462 3/20 0.66
HTR2A P28223 3/20 0.66
HTR2C P28335 2/20 0.66
HRH1 P35367 2/20 0.66
SIGMAR1 Q99720 2/20 0.60
SLC6A4 P31645 2/20 0.60
CHRM1 P11229 1/20 0.60
DRD1 P21728 1/20 0.60
HTR2B P41595 1/20 0.60
HTR6 P50406 1/20 0.60
SLC6A3 Q01959 1/20 0.60
TMEM97 Q5BJF2 1/20 0.60
KDM4E B2RXH2 1/20 0.60
GAA P10253 1/20 0.60
HTR7 P34969 1/20 0.59

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
SCHEMBL7949281 0.88 CACNA1G (0.69) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL6368839 0.87 CACNA1G (0.60) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL3197065 0.86 CACNA1G (0.52) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL2386501 0.86 GFER (0.54) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL3197900 0.85 HTR1A (0.66) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL3207003 0.84 HTR1A (0.67) CACNA1GDRD2HTR1ADRD3HTR2A
SCHEMBL3187888 0.84 KCNH2 (0.74) CACNA1GDRD4DRD2HTR1AHTR2A
SCHEMBL18754269 0.84 KDM4E (0.75) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL8608402 0.83 SMN1; SMN2 (0.71) CACNA1GDRD4DRD2HTR1ADRD3
SCHEMBL4400390 0.83 SMN1; SMN2 (0.66) DRD4HTR1AKDM4EHTR7

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
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
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 disclosed
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 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 CACNA1G 245/4885DRD4 26/4885DRD2 13/4885

“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.