SCHEMBL6337374

SCHEMBL6337374

O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 8/20 0.77
EPHX2 P34913 5/20 0.63
EPHX1 P07099 2/20 0.63
TMEM97 Q5BJF2 2/20 0.58
SLC6A2 P23975 1/20 0.57
SLC6A3 Q01959 1/20 0.57
MAPK1 P28482 1/20 0.56

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
SCHEMBL6331510 0.97 CCR3 (0.81) CCR3EPHX2EPHX1SLC6A2SLC6A3
SCHEMBL6407882 0.85 CCR3 (0.65) CCR3EPHX2EPHX1MAPK1
SCHEMBL6330827 0.81 CCR3 (0.93) CCR3TMEM97SLC6A2SLC6A3
SCHEMBL6338952 0.79 EPHX2 (0.55) CCR3EPHX2EPHX1SLC6A2SLC6A3
SCHEMBL7499307 0.79 EPHX2 (0.55) CCR3EPHX2EPHX1SLC6A2SLC6A3
SCHEMBL12931905 0.78 EPHX2 (0.90) EPHX2EPHX1MAPK1
SCHEMBL6333410 0.78 EPHX2 (0.62) CCR3EPHX2EPHX1MAPK1
SCHEMBL4199400 0.78 EPHX2 (1.00) EPHX2EPHX1MAPK1
SCHEMBL12196187 0.78 EPHX2 (1.00) EPHX2EPHX1MAPK1
SCHEMBL14559598 0.77 CCR3 (0.75) CCR3TMEM97SLC6A2SLC6A3

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 7 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
EP-1140086-A4 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARM CO (US) 2002-04-03 EP disclosed
EP-1140086-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-10-10 EP disclosed
WO-2000035451-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 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-20040058960-A1 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity CCR3, CCR1, CCR10 CCR3 1/4885EPHX2 1687/4885EPHX1 1290/4885

“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.