SCHEMBL4841756

SCHEMBL4841756

NC(=O)CCC(=O)N[C@@H]1CN2C(=O)N(c3cc(Cl)cc(Cl)c3)C(=O)[C@@]2(Cc2ccc(OC(F)(F)F)cc2)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.37
METAP2 P50579 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CCR2 P41597 3/20 0.36
GCGR P47871 2/20 0.36
LIPE Q05469 7/20 0.36
SCN9A Q15858 1/20 0.35
KCNH2 Q12809 1/20 0.34
MCHR1 Q99705 1/20 0.34
TEAD1 P28347 1/20 0.34
EPHX2 P34913 1/20 0.33

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
SCHEMBL6478158 0.88 UTS2R (0.37) CHRM4METAP2L3MBTL1CCR2GCGR
SCHEMBL4844861 0.88 METAP2 (0.39) METAP2GCGRLIPESCN9ATEAD1
SCHEMBL4850172 0.88 KDM1A (0.36) CHRM4METAP2CCR2GCGRLIPE
SCHEMBL4848881 0.87 GCGR (0.38) CHRM4L3MBTL1CCR2GCGRLIPE
SCHEMBL4848621 0.85 METAP2 (0.39) METAP2CCR2GCGRLIPESCN9A
SCHEMBL4704040 0.85 ITGAL (0.43)
SCHEMBL6478251 0.84 LIPE (0.37) CHRM4METAP2CCR2GCGRLIPE
SCHEMBL6477360 0.84 GCGR (0.35) METAP2GCGRLIPETEAD1EPHX2
SCHEMBL4841580 0.83 METAP2 (0.39) METAP2GCGRLIPESCN9ATEAD1
SCHEMBL6478087 0.83 GCGR (0.36) CHRM4L3MBTL1CCR2GCGRLIPE

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-6897225-B1 Inhibitors of αLβ2 mediated cell adhesion TANABE SEIYAKU CO., LTD. (JP) 2005-05-24 US claimed
EP-1307455-B1 INHIBITORS OF ALPHA-L BETA-2 MEDIATED CELL ADHESION TANABE SEIYAKU CO (JP) 2005-04-06 EP claimed
US-7342012-B2 Inhibitors of αLβ2 mediated cell adhesion MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-03-11 US disclosed
US-20050148602-A1 Inhibitors of alphaLbeta2 mediated cell adhesion TANABE SEIYAKU CO., LTD. 2005-07-07 US disclosed
US-6897225-B1 Inhibitors of αLβ2 mediated cell adhesion TANABE SEIYAKU CO., LTD. (JP) 2005-05-24 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-20050148602-A1 Inhibitors of alphaLbeta2 mediated cell adhesion ITGB2, ITGA2B, ITGB1 CHRM4 2451/4885METAP2 1571/4885L3MBTL1 812/4885

“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.