SCHEMBL6458967

SCHEMBL6458967

Cc1ccc(O)c(C(=O)[AsH]Cc2ccc(CNC(=O)c3cccnc3Oc3ccc(F)cc3)cc2)c1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.54
MAPK8 P45983 1/20 0.52
HPGD P15428 2/20 0.50
GAA P10253 1/20 0.49
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL6049474 0.93 MAPK8 (0.55) PTGER4MAPK8HPGDLMNASMN1; SMN2
SCHEMBL4085497 0.91 PTGER4 (0.60) PTGER4MAPK8HPGDGAALMNA
SCHEMBL4086021 0.86 MAPK8 (0.59) PTGER4MAPK8HPGDGAALMNA
SCHEMBL4081701 0.84 MAPK8 (0.64) PTGER4MAPK8HPGDLMNASMN1; SMN2
SCHEMBL4087178 0.82 MAPK8 (0.69) PTGER4MAPK8HPGDLMNASMN1; SMN2
SCHEMBL7317640 0.82 MAPK8 (0.75) PTGER4MAPK8HPGDLMNASMN1; SMN2
SCHEMBL4085475 0.81 MAPK8 (0.62) PTGER4MAPK8HPGDLMNASMN1; SMN2
SCHEMBL7168843 0.80 MAPK8 (0.72) PTGER4MAPK8GAA
SCHEMBL7371983 0.80 MAPK8 (0.69) PTGER4MAPK8HPGDLMNASMN1; SMN2
SCHEMBL4455558 0.79 MAPK8 (0.62) PTGER4MAPK8HPGDLMNASMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050043343-A1 Medicaments for inhalation comprising an anticholinergic and a PDE IV inhibitor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-02-24 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-20050043343-A1 Medicaments for inhalation comprising an anticholinergic and a PDE IV inhibitor PDE3A, PDE4B, PDE12 PTGER4 230/4885MAPK8 3666/4885HPGD 663/4885

“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.