SCHEMBL4844697

SCHEMBL4844697

O=C(O)CCc1ccccc1-c1ccc(CC23CCCCN2C(=O)N(c2cc(Cl)cc(Cl)c2)C3=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 6/20 0.40
PTGER3 P43115 6/20 0.40
PTGER1 P34995 5/20 0.40
PTGER2 P43116 5/20 0.40
FFAR4 Q5NUL3 11/20 0.39
FFAR1 O14842 10/20 0.39
METAP2 P50579 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
LPAR1 Q92633 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
SCHEMBL4848701 0.90 REN (0.34) PTGER4PTGER3PTGER1PTGER2FFAR4
SCHEMBL4845247 0.90 REN (0.34) FFAR4FFAR1METAP2
SCHEMBL4843286 0.89 FPR1 (0.35) METAP2
SCHEMBL4841624 0.88 ITGAL (0.35) METAP2
SCHEMBL4848531 0.86 AGTR1 (0.44)
SCHEMBL4845206 0.84 GRM2 (0.40)
SCHEMBL4841738 0.82 ITGAL (0.35) METAP2
SCHEMBL4847245 0.81 ACHE (0.46)
SCHEMBL4848901 0.81 MEN1 (0.38)
Dimethylamine SCHEMBL4845222 0.81 ITGAL (0.36) FFAR1METAP2

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-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
EP-1307455-B1 INHIBITORS OF ALPHA-L BETA-2 MEDIATED CELL ADHESION TANABE SEIYAKU CO (JP) 2005-04-06 EP 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 PTGER4 1754/4885PTGER3 2149/4885PTGER1 1079/4885

“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.