SCHEMBL24035501

SCHEMBL24035501

OCc1ccc(C2=NOCC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
CHRNB4 P30926 2/20 0.35
CHRNA3 P32297 2/20 0.35
PTGS2 P35354 2/20 0.35
CHRNA7 P36544 1/20 0.35
PDCD1 Q15116 4/20 0.35
CD274 Q9NZQ7 4/20 0.35
KDM1A O60341 1/20 0.33
TSHR P16473 1/20 0.32
PIK3CA P42336 4/20 0.32
MTOR P42345 3/20 0.32
PIK3CG P48736 3/20 0.32
PIK3CD O00329 2/20 0.32
FYN P06241 1/20 0.31
KIF11 P52732 1/20 0.31
PIK3CB P42338 1/20 0.31
PRKDC P78527 1/20 0.31
SSTR5 P35346 1/20 0.31

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
SCHEMBL667853 0.79 ESR1 (0.42)
SCHEMBL20244316 0.75 MMP2 (0.36)
SCHEMBL27411282 0.75 POLB (0.41) TSHR
SCHEMBL27490806 0.75 CHRNB4 (0.39) CHRNB4CHRNA3
SCHEMBL30594257 0.75 MAOB (0.39)
SCHEMBL570014 0.74 CHRNB4 (0.42) CHRNB4CHRNA3
SCHEMBL27499092 0.71 NQO2 (0.46)
SCHEMBL28896993 0.70 CLK4 (0.44)
SCHEMBL6070922 0.70
SCHEMBL8191317 0.70 NOTUM (0.44) PTGS2KIF11

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-20210353767-A1 COMPOSITIONS AND METHODS FOR DRUG DELIVERY NORTH CAROLINA STATE UNIVERSITY 2021-11-18 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-20210353767-A1 COMPOSITIONS AND METHODS FOR DRUG DELIVERY ABCB1, LIPA, ABCB11 MKNK1 4376/4885MKNK2 3944/4885CHRNB4 2797/4885

“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.