SCHEMBL26039859

SCHEMBL26039859

C=C(C)C(=O)OC(C)Cn1cc(-c2ccc(OC)cc2)c(=O)[nH]c1=S

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 2/20 0.35
TP53 P04637 1/20 0.35
ALOX12 P18054 1/20 0.35
GFER P55789 1/20 0.35
TYMS P04818 1/20 0.34
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ERCC5 P28715 1/20 0.33
FEN1 P39748 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 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
SCHEMBL26039652 0.91 TYMS (0.39) ALDH1A1MAPTHPGDGFERTYMS
SCHEMBL26039881 0.89 MET (0.38) ALDH1A1MAPTALOX12GFERKDM4E
SCHEMBL26034726 0.84 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL26064061 0.80 GFER (0.35) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL26034691 0.76 TYMS (0.42) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL26063147 0.76 MMP9 (0.36) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL26064038 0.74 PKM (0.40) ALDH1A1LMNA
SCHEMBL26034728 0.72 ASAH1 (0.38) ALDH1A1GFERKDM4ECA1CA2
SCHEMBL26035400 0.71 CYP2C9 (0.44) MEN1KMT2AMAPTPOLBGFER
SCHEMBL26039535 0.67 PKM (0.52) ALDH1A1LMNA

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-20230273455-A1 OPTICALLY ACTIVE DEVICES JOHNSON & JOHNSON SURGICAL VISION INC (US) 2023-08-31 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-20230273455-A1 OPTICALLY ACTIVE DEVICES PDE6C, PDE6A, PDE6D ALDH1A1 311/4885MEN1 3042/4885KMT2A 4011/4885

“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.