SCHEMBL18840697

SCHEMBL18840697

CC(=O)c1cccc(NC(=O)NCCCN2CCC[C@@H](Cc3ccc(F)cc3)C2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 20/20 1.00
CYP2D6 P10635 7/20 1.00
HTR2A P28223 6/20 1.00
SLC6A2 P23975 2/20 0.68
SLC6A4 P31645 2/20 0.68
SLC6A3 Q01959 2/20 0.68
DRD2 P14416 1/20 0.68
KCNH2 Q12809 1/20 0.68

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
SCHEMBL6331979 1.00 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6337414 0.97 CCR3 (0.95) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL18840700 0.93 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6329817 0.93 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6330810 0.93 CCR3 (0.86) CCR3CYP2D6HTR2A
SCHEMBL6338410 0.92 CCR3 (0.86) CCR3CYP2D6HTR2A
SCHEMBL6329008 0.90 CCR3 (0.95) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6331384 0.90 CCR3 (0.82) CCR3CYP2D6HTR2A
SCHEMBL6332770 0.89 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6339155 0.89 CCR3 (0.87) CCR3CYP2D6HTR2A

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-10401365-B2 Inhibition of chemokine CCL7 or receptor CCR3 of same for the treatment and diagnosis of prostate cancer UNIVERSITE PAUL SABATIER (TOULOUSE III) (FR) 2019-09-03 US disclosed
US-20170131282-A1 Inhibition of Chemokine CCL7 or Receptor CCR3 of Same for the Treatment and Diagnosis of Prostate Cancer INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2017-05-11 US disclosed
US-20170131282-A1 Inhibition of Chemokine CCL7 or Receptor CCR3 of Same for the Treatment and Diagnosis of Prostate Cancer INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2017-05-11 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 (2 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-20170131282-A1 Inhibition of Chemokine CCL7 or Receptor CCR3 of Same for the Treatment and Diagnosis of Prostate Cancer CCR3, CCR5, CCR1 CCR3 1/4885CYP2D6 3121/4885HTR2A 3855/4885
US-10401365-B2 Inhibition of chemokine CCL7 or receptor CCR3 of same for the treatment and diagnosis of prostate cancer CCR3, CCR5, CCR1 CCR3 1/4885CYP2D6 3241/4885HTR2A 3883/4885

“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.