SCHEMBL5489840

SCHEMBL5489840

Nc1ccc2nc(SCC(=O)NC3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)sc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 7/20 1.00
CCR1 P32246 5/20 1.00
ALDH1A1 P00352 6/20 0.54
MAPT P10636 5/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
APOBEC3A P31941 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
SIGMAR1 Q99720 2/20 0.53
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MCHR1 Q99705 1/20 0.50
LMNA P02545 2/20 0.48
ESR1 P03372 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL18844210 0.93 CCR3 (0.88) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL14454576 0.93 CCR3 (0.87) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL18840726 0.90 CCR3 (1.00) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL18840724 0.87 CCR3 (1.00) CCR3CCR1MAPTMEN1KMT2A
SCHEMBL18840693 0.86 CCR3 (1.00) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL2213599 0.83 CCR3 (0.71) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL1812120 0.82 CCR3 (0.69) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL1812124 0.82 CCR3 (0.69) CCR3CCR1ALDH1A1MAPTMEN1
SCHEMBL4034267 0.81 CCR3 (0.84) CCR3CCR1ALDH1A1MEN1KMT2A
SCHEMBL2212518 0.81 CCR3 (0.70) CCR3CCR1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155663-A1 Use of chemokine receptor agonists for stem cell transplantation TAP PHARMACEUTICAL PRODUCTS INC. 2007-07-05 US claimed
EP-1605966-A1 USE OF CHEMOKINE RECEPTOR AGONISTS FOR STEM CELL TRANSPLANTATION TAP Pharmaceutical Products, Inc. (US) 2005-12-21 EP claimed
WO-2004084931-A1 USE OF CHEMOKINE RECEPTOR AGONISTS FOR STEM CELL TRANSPLANTATION TAP PHARMACEUTICALS PRODUCTS INC. (US) 2004-10-07 WO claimed
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

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 1/4885CCR1 3/4885ALDH1A1 1318/4885
US-10401365-B2 Inhibition of chemokine CCL7 or receptor CCR3 of same for the treatment and diagnosis of prostate cancer CCR3, CCR5, CCR1 CCR3 1/4885CCR1 3/4885ALDH1A1 1281/4885

“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.