SCHEMBL7124387

SCHEMBL7124387

CS(=O)(=O)c1cc(Cl)c(OCCCN2CCN(c3cccc4ccsc34)CC2)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.55
HTR2A P28223 4/20 0.55
HTR1A P08908 4/20 0.55
HTR7 P34969 1/20 0.40
DRD3 P35462 1/20 0.40
KCNH2 Q12809 1/20 0.40
ADRA1D P25100 1/20 0.40
HTR1B P28222 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40

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
SCHEMBL7117583 0.85 DRD2 (0.55) DRD2HTR2AHTR1AHTR7DRD3
SCHEMBL7120429 0.83 DRD2 (0.52) DRD2HTR2AHTR1ADRD3KCNH2
SCHEMBL7127121 0.80 HTR1A (0.52) DRD2HTR1A
SCHEMBL7121850 0.79 HTR2A (0.56) DRD2HTR2AHTR1AHTR7
SCHEMBL7118961 0.78 HTR2A (0.55) DRD2HTR2AHTR1AHTR7KCNH2
SCHEMBL7120413 0.76 HTR1A (0.53) DRD2HTR2AHTR1AHTR7DRD3
SCHEMBL7128893 0.76 HTR2A (0.55) DRD2HTR2AHTR1AHTR7KCNH2
SCHEMBL7122142 0.76 HTR2A (0.54) DRD2HTR2AHTR1AHTR7
SCHEMBL7119229 0.75 HTR2A (0.58) DRD2HTR2AHTR1AKCNH2
SCHEMBL7119957 0.74 DRD2 (0.50) DRD2HTR2AHTR1ADRD3KCNH2

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-20030050306-A1 Novel heteroaryl derivatives, their preparation and use H. LUNDBECK A/S (DK) 2003-03-13 US claimed
US-20030050306-A1 Novel heteroaryl derivatives, their preparation and use H. LUNDBECK A/S (DK) 2003-03-13 US disclosed
EP-1246820-A1 NOVEL HETEROARYL DERIVATIVES, THEIR PREPARATION AND USE H. LUNDBECK A/S (DK) 2002-10-09 EP disclosed
WO-2001049683-A1 NOVEL HETEROARYL DERIVATIVES, THEIR PREPARATION AND USE H. LUNDBECK A/S (DK) 2001-07-12 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-20030050306-A1 Novel heteroaryl derivatives, their preparation and use CRBN, CDR2, DRD3 DRD2 7/4885HTR2A 176/4885HTR1A 74/4885

“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.