SCHEMBL6330827

SCHEMBL6330827

O=C(NCCCCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1

nearest known ligand 0.93

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 13/20 0.93
MEN1 O00255 1/20 0.76
POLB P06746 1/20 0.76
KMT2A Q03164 1/20 0.76
HTR2A P28223 2/20 0.71
RAB9A P51151 1/20 0.70
TMEM97 Q5BJF2 2/20 0.65
SLC6A2 P23975 1/20 0.64
SLC6A3 Q01959 1/20 0.64
CCR2 P41597 1/20 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
SCHEMBL6339130 0.96 CCR3 (1.00) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6332953 0.90 CCR3 (0.76) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6337096 0.90 CCR3 (0.81) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6336125 0.89 CCR3 (0.92) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6330724 0.89 CCR3 (0.74) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6337636 0.89 CCR3 (0.74) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6329088 0.87 CCR3 (0.94) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6337783 0.87 CCR3 (1.00) CCR3HTR2A
SCHEMBL6330976 0.86 CCR3 (0.74) CCR3MEN1POLBKMT2AHTR2A
SCHEMBL6331158 0.86 CCR3 (0.81) CCR3MEN1POLBKMT2AHTR2A

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
EP-1140086-A4 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARM CO (US) 2002-04-03 EP claimed
EP-1140086-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-10-10 EP claimed
WO-2000035451-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 WO 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 1/4885MEN1 4757/4885POLB 3083/4885

“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.