SCHEMBL3618110

SCHEMBL3618110

C[C@H](O)[C@H]1COC[C@@H](c2ccc(Cl)cc2)N1

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.32
MAOA P21397 1/20 0.32
CXCL12 P48061 1/20 0.32
SLC6A3 Q01959 5/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
MDM2 Q00987 1/20 0.31
MAPK1 P28482 1/20 0.31
TAAR1 Q96RJ0 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL2344424 1.00 CHRNA7 (0.32) CHRNA7MAOACXCL12SLC6A3SLC6A2
SCHEMBL2353741 0.81 IDO1 (0.32)
SCHEMBL2346521 0.80 SLC6A3 (0.36) SLC6A3SLC6A2SLC6A4KDM4EMAPT
SCHEMBL3619366 0.75
SCHEMBL2351660 0.75
SCHEMBL2350152 0.75
SCHEMBL27770651 0.74 SLC6A2 (0.42) SLC6A3SLC6A2SLC6A4MEN1KMT2A
SCHEMBL2345307 0.74 SLC6A2 (0.42) SLC6A3SLC6A2SLC6A4MEN1KMT2A
SCHEMBL2353941 0.71 MEN1 (0.41) MAOASLC6A3MEN1ALDH1A1KMT2A
SCHEMBL23241191 0.68 MDM2 (0.32) SLC6A3MDM2

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 CHRNA7 3822/4885MAOA 921/4885CXCL12 1019/4885

“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.