SCHEMBL3623728

SCHEMBL3623728

O=C1C[C@H]2CCCC(=O)N2[C@H](c2cc(F)c(F)c(F)c2)C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
P2RX7 Q99572 3/20 0.32

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
SCHEMBL3623230 1.00 MAPK1 (0.33) MAPK1P2RX7
SCHEMBL3623316 0.87 P2RX7 (0.36) P2RX7
SCHEMBL5126234 0.87 P2RX7 (0.36) P2RX7
SCHEMBL3627713 0.87 P2RX7 (0.36) P2RX7
SCHEMBL2579829 0.87 P2RX7 (0.36) P2RX7
SCHEMBL4513877 0.86 L3MBTL1 (0.34) MAPK1P2RX7
SCHEMBL2577904 0.84 P2RX7 (0.33) P2RX7
SCHEMBL4514655 0.82 TSHR (0.42) MAPK1
SCHEMBL2584768 0.80 RIPK1 (0.31) P2RX7
SCHEMBL4513488 0.80 P2RX7 (0.32) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737141-B2 such as -{4-{1-[(S)-1-(4-fluorophenyl)ethyl]-2-oxopiperidin-(3E)-ylidenemethyl}-2-methoxyphenyl}-5-methyl-1-(phosphonooxymethyl)-3H-imidazol-1-ium trifluoroacetate, which inhibit the synthesis of amyloid precursor proteins; treatment of Alzheimer's disease, Down syndrome or amyloidosis EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-06-15 US disclosed
EP-2048143-A1 PRODRUG OF CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed
US-20090048213-A1 Prodrug of cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2009-02-19 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-20090048213-A1 Prodrug of cinnamide compound BTK, CNKSR1, AKT1 MAPK1 1605/4885P2RX7 740/4885

“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.