SCHEMBL6770131

SCHEMBL6770131

CS(=O)(=O)c1ccc(CN2CCCN(CC(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.78
LMNA P02545 1/20 0.54
CXCR4 P61073 2/20 0.49
DRD2 P14416 1/20 0.49

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
SCHEMBL6770892 0.82 CCR2 (0.87) CCR2
SCHEMBL7922568 0.81 CCR2 (0.59) CCR2LMNA
SCHEMBL6766190 0.80 CCR2 (0.84) CCR2LMNA
SCHEMBL8236801 0.79 HRH3 (0.64) CCR2LMNACXCR4
SCHEMBL16226160 0.79 KDM4E (0.72) LMNA
SCHEMBL6770077 0.76 CCR2 (0.65) CCR2LMNA
SCHEMBL8458456 0.75 CCR2 (0.65) CCR2LMNA
SCHEMBL23775098 0.75 ALDH1A1 (0.50) CCR2
SCHEMBL9720769 0.75 KDM4E (0.62)
SCHEMBL22516895 0.74 CCR2 (0.59) CCR2LMNA

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-6686353-B1 PREVENTING BLOOD MONOCYTES AND LYMPHOCYTES FROM INFILTRATING TISSUE TEIJIN INTELLECTUAL PROPERTY CENTER LIMITED (JP) 2004-02-03 US disclosed
EP-0914319-B1 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS TEIJIN LTD (JP) 2001-11-21 EP disclosed
EP-0914319-A1 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS TEIJIN LIMITED (JP) 1999-05-12 EP disclosed
WO-1997044329-A1 DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS TEIJIN LIMITED (JP) 1997-11-27 WO disclosed