SCHEMBL166559

SCHEMBL166559

COC(=O)c1ccccc1CCNC(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
ALDH1A1 P00352 2/20 0.55
NQO2 P16083 1/20 0.54
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KCNA5 P22460 1/20 0.47
IDO1 P14902 4/20 0.46
TSHR P16473 2/20 0.46
MEN1 O00255 1/20 0.46
NAMPT P43490 1/20 0.45
MALT1 Q9UDY8 1/20 0.44
DRD2 P14416 3/20 0.44
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
BCHE P06276 1/20 0.43

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
SCHEMBL375745 0.92 ALDH1A1 (0.52) LMNAALDH1A1NQO2KMT2AKCNA5
SCHEMBL20777755 0.87 NQO2 (0.55) LMNAALDH1A1NQO2KMT2ANPC1
SCHEMBL6094751 0.87 NQO2 (0.55) LMNANQO2KMT2AKCNA5IDO1
SCHEMBL4079237 0.86 ALDH1A1 (0.52) LMNAALDH1A1NQO2KMT2ANPC1
SCHEMBL31331976 0.86 NQO2 (0.58) LMNAALDH1A1NQO2KMT2ANPC1
SCHEMBL2158784 0.86 KCNA5 (0.55) LMNAALDH1A1KMT2AKCNA5TSHR
SCHEMBL24086511 0.85 NQO2 (0.53) LMNANQO2KMT2AKCNA5IDO1
SCHEMBL26673798 0.84 IDO1 (0.46) LMNAALDH1A1NQO2KMT2ANPC1
SCHEMBL28163365 0.84 NQO2 (0.50) LMNAALDH1A1NQO2KMT2AKCNA5
SCHEMBL3995767 0.84 NAMPT (0.47) LMNAALDH1A1NQO2KMT2ANPC1

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-20210380548-A1 Fused [1,2,4]Thiadiazine Derivatives Which Act as KAT Inhibitors of the MYST Family CTXT PTY LIMITED (AU) 2021-12-09 US disclosed
WO-2019043139-A1 FUSED [1,2,4]THIADIAZINE DERIVATIVES WHICH ACT AS KAT INHIBITORS OF THE MYST FAMILY CTXT PTY LIMITED (AU) 2019-03-07 WO 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-20210380548-A1 Fused [1,2,4]Thiadiazine Derivatives Which Act as KAT Inhibitors of the MYST Family KAT5, KAT6A, KAT2A LMNA 4612/4885ALDH1A1 2920/4885NQO2 3187/4885

“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.