SCHEMBL17014179

SCHEMBL17014179

C=CCN(CC(=NO)c1ccc(F)cn1)B(C)O

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MT-CO1 P00395 1/20 0.30
MT-CO2 P00403 1/20 0.30
EDNRA P25101 1/20 0.30
OPRM1 P35372 1/20 0.30
HTR2B P41595 1/20 0.30
KCNH2 Q12809 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
SCHEMBL15662249 0.78 SMN1; SMN2 (0.40)
SCHEMBL15662250 0.78 SMN1; SMN2 (0.40)
SCHEMBL17014183 0.78 KDM4E (0.31)
SCHEMBL17014184 0.74 SMN1; SMN2 (0.35)
SCHEMBL18306897 0.74 SMN1; SMN2 (0.35)
SCHEMBL15294847 0.74 ATM (0.34)
SCHEMBL15294850 0.70 ALDH1A1 (0.34)
SCHEMBL15294849 0.70
SCHEMBL1693716 0.67 MT-CO1 (0.36) MT-CO1MT-CO2EDNRAOPRM1HTR2B
SCHEMBL31607681 0.67 MT-CO1 (0.36) MT-CO1MT-CO2EDNRAOPRM1HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9328124-B2 BACE inhibitors ELI LILLY AND COMPANY (US) 2016-05-03 US disclosed
US-20150232483-A1 BACE INHIBITORS ELI LILLY AND COMPANY 2015-08-20 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-20150232483-A1 BACE INHIBITORS BACE1, BACE2, APP MT-CO1 1583/4885MT-CO2 2632/4885EDNRA 426/4885

“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.