SCHEMBL6329008

SCHEMBL6329008

CC(=O)c1cc(NC(=O)NCCCCN2CCCC(Cc3ccc(F)cc3)C2)cc(C(C)=O)c1

nearest known ligand 0.95

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 20/20 0.95
CYP2D6 P10635 7/20 0.95
HTR2A P28223 3/20 0.82
SLC6A2 P23975 5/20 0.63
SLC6A4 P31645 5/20 0.63
SLC6A3 Q01959 5/20 0.63

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
SCHEMBL6329817 0.97 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL18840700 0.97 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6337414 0.93 CCR3 (0.95) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL18840697 0.90 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6331979 0.90 CCR3 (1.00) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6340295 0.89 CCR3 (0.81) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6333585 0.89 CCR3 (0.75) CCR3CYP2D6HTR2A
SCHEMBL6335958 0.86 CCR3 (0.75) CCR3CYP2D6HTR2A
SCHEMBL6338591 0.86 CCR3 (0.86) CCR3CYP2D6HTR2ASLC6A2SLC6A4
SCHEMBL6331117 0.86 CCR3 (0.79) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058960-A1 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-03-25 US claimed
US-6906066-B2 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-06-14 US disclosed
US-20040058960-A1 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-03-25 US disclosed
US-6605623-B1 Prevention of asthma and other allergic diseases BRISTOL-MYERS SQUIBB PHARMA CO. 2003-08-12 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 (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-20040058960-A1 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity CCR3, CCR1, CCR10 CCR3 1/4885CYP2D6 3262/4885HTR2A 1608/4885

“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.