SCHEMBL25329488

SCHEMBL25329488

C#CC(=O)OC(C)=CC(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NFE2L2 Q16236 1/20 0.46
MAPT P10636 7/20 0.41
RAB9A P51151 6/20 0.41
NPC1 O15118 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 3/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC3 O15379 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
GAA P10253 3/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
AKT1 P31749 2/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL25329486 1.00 MEN1 (0.46) MEN1KMT2ANFE2L2MAPTRAB9A
SCHEMBL25327872 0.81 NFE2L2 (0.53) MEN1KMT2ANFE2L2MAPTRAB9A
SCHEMBL25327868 0.81 NFE2L2 (0.53) MEN1KMT2ANFE2L2MAPTRAB9A
SCHEMBL25329693 0.80 MEN1 (0.42) MEN1KMT2ANFE2L2MAPTRAB9A
SCHEMBL25329696 0.80 MEN1 (0.42) MEN1KMT2ANFE2L2MAPTRAB9A
Benzoic Acid SCHEMBL28413278 0.73 TSHR (0.58) TP53ALDH1A1CYP2C9CES2CES1
SCHEMBL27626057 0.73 LMNA (0.52) MEN1KMT2AMAPTSMN1; SMN2MAPK1
SCHEMBL25327818 0.73 SMN1; SMN2 (0.46) MEN1KMT2ANFE2L2MAPTRAB9A
SCHEMBL25327815 0.73 SMN1; SMN2 (0.46) MEN1KMT2ANFE2L2MAPTRAB9A
SCHEMBL28615186 0.73 HDAC1 (0.50) MEN1KMT2ANFE2L2MAPTRAB9A

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-20230242572-A1 a-CARBONYL ALKENYL ESTER PREPARATION METHOD THEREFOR AND APPLICATION THEREOF JIANGXI NORMAL UNIVERSITY (CN) 2023-08-03 US claimed
US-20230242572-A1 a-CARBONYL ALKENYL ESTER PREPARATION METHOD THEREFOR AND APPLICATION THEREOF JIANGXI NORMAL UNIVERSITY (CN) 2023-08-03 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-20230242572-A1 a-CARBONYL ALKENYL ESTER PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ACSL1, ACSL4, WEE1 MEN1 1216/4885KMT2A 3061/4885NFE2L2 1108/4885

“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.