SCHEMBL15979025

SCHEMBL15979025

CCOC(=O)C1CC(CC)(C(=O)OCC)CCC1=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
MAPT P10636 4/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
TLR4 O00206 1/20 0.36
POLB P06746 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 2/20 0.33
PKM P14618 1/20 0.33
ATM Q13315 1/20 0.33
RECQL P46063 1/20 0.32
RAB9A P51151 1/20 0.32
HIF1A Q16665 1/20 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
SCHEMBL7663667 0.82 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL1338366 0.79 ALDH1A1 (0.45) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL15416184 0.79 MAPT (0.43) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL1700776 0.78 ALDH1A1 (0.41) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL5111017 0.77 TLR4 (0.43) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL25981634 0.77 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL14731543 0.75 TLR4 (0.39) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL15684078 0.75 ALDH1A1 (0.45) ALDH1A1MAPTKDM4EMEN1GAA
SCHEMBL5949812 0.75 POLB (0.41) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL30727078 0.74 TLR4 (0.39) ALDH1A1MAPTKDM4EMEN1GAA

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-20140243302-A1 BRIDGED BICYCLIC COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS MERCK SHARP & DOHME CORPORATION (US) 2014-08-28 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-20140243302-A1 BRIDGED BICYCLIC COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS PAICS, SBDS, SORD ALDH1A1 802/4885MAPT 2221/4885KDM4E 4131/4885

“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.