SCHEMBL6408957

SCHEMBL6408957

COc1ccc(NCCNc2ccc(Cl)c(Cl)c2)cc1OCCN1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 15/20 0.61
HTR2A P28223 12/20 0.61
HTR2B P41595 10/20 0.61
EPHA2 P29317 3/20 0.60
KDR P35968 3/20 0.60
EPHB4 P54760 3/20 0.60
ADRA1D P25100 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
DRD3 P35462 1/20 0.54
EGFR P00533 2/20 0.52

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
SCHEMBL6415399 0.89 HTR2C (0.63) HTR2CHTR2AHTR2BEPHA2KDR
SCHEMBL6408213 0.86 HTR2C (0.55) HTR2CHTR2AHTR2BEPHA2KDR
SCHEMBL6410846 0.85 EPHA2 (0.48) HTR2CHTR2AHTR2BEPHA2KDR
SCHEMBL6408467 0.81 HTR2A (0.58) HTR2CHTR2AHTR2BEPHA2KDR
SCHEMBL6410204 0.80 HTR2C (0.49) HTR2CHTR2AHTR2B
SCHEMBL7092826 0.78 MCHR1 (0.50) HTR2CHTR2AHTR2B
SCHEMBL6413627 0.78 UTS2R (0.57) HTR2CHTR2AKDREGFR
SCHEMBL6408932 0.76 HTR2C (1.00) HTR2CHTR2AHTR2BADRA1DADRA1A
SCHEMBL906652 0.75 KDR (1.00) EPHA2KDREPHB4EGFR
SCHEMBL13946676 0.74 HTR2A (0.50) HTR2CHTR2AHTR2BEPHA2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050154028-A1 Cyclic urea derivatives with 5-ht2c receptor activity GLAXO GROUP LIMITED (GB) 2005-07-14 US disclosed
EP-1465630-A1 CYCLIC UREA DERIVATIVES WITH 5-HT2C RECEPTOR ACTIVITY GLAXO GROUP LIMITED (GB) 2004-10-13 EP disclosed
WO-2003057220-A1 CYCLIC UREA DERIVATIVES WITH 5-HT2C RECEPTOR ACTIVITY GLAXO GROUP LIMITED (GB) 2003-07-17 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-20050154028-A1 Cyclic urea derivatives with 5-ht2c receptor activity HTR2C, HTR3C, HTR5A HTR2C 1/4885HTR2A 30/4885HTR2B 28/4885

“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.