SCHEMBL23219624

SCHEMBL23219624

CC(C)COC(=O)CCC1NC(=O)OC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
EPHX2 P34913 1/20 0.33
PPARG P37231 1/20 0.33
NCOA2 Q15596 1/20 0.33
NCOA1 Q15788 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
ADORA2B P29275 4/20 0.32
ADORA1 P30542 1/20 0.32
MCL1 Q07820 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 5/20 0.31
TDP1 Q9NUW8 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 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
SCHEMBL14366420 0.84 CYP1A2 (0.37) POLBGAAHPGDHSD17B10TSHR
SCHEMBL796887 0.84 CYP1A2 (0.37) POLBGAAHPGDHSD17B10TSHR
SCHEMBL14104694 0.80 TSHR (0.39) GAAPPARGHSD17B10TSHRTDP1
SCHEMBL14671140 0.79 PRKCA (0.40) GAAKDM4EALDH1A1LMNACYP2C9
SCHEMBL19472859 0.77 POLB (0.30) POLBHSD17B10TDP1L3MBTL1
SCHEMBL12328017 0.77 ABCG2 (0.34) POLBGAAEPHX2CYP2C9
SCHEMBL11957433 0.77 ABCG2 (0.34) POLBGAAEPHX2CYP2C9
SCHEMBL20313351 0.74 PRKCA (0.34) ALDH1A1
SCHEMBL9886383 0.73
SCHEMBL12657343 0.73 NPSR1 (0.44) PPARGNPSR1KDM4ETDP1L3MBTL1

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
EP-3572408-B1 METHOD FOR PURIFYING AN AMINO ACID-N-CARBOXY ANHYDRIDE SHINETSU CHEMICAL CO (JP) 2021-10-27 EP disclosed
US-10975042-B2 Method for purifying an amino acid-n-carboxy anhydride SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-04-13 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-10975042-B2 Method for purifying an amino acid-n-carboxy anhydride NAAA, NPPA, NCAPH POLB 2704/4885GAA 1823/4885EPHX2 1386/4885

“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.