SCHEMBL25263407

SCHEMBL25263407

O=C(O)C(=O)c1ccnc(Br)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
KDM4E B2RXH2 4/20 0.42
KDM5C P41229 4/20 0.42
KDM4C Q9H3R0 4/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4A O75164 3/20 0.42
KDM6B O15054 3/20 0.42
KDM2A Q9Y2K7 3/20 0.42
KDM3A Q9Y4C1 3/20 0.42
KDM5B Q9UGL1 2/20 0.42
TET3 O43151 1/20 0.42
BBOX1 O75936 1/20 0.42
MAPT P10636 1/20 0.42
KDM5A P29375 1/20 0.42
ASPH Q12797 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
TET2 Q6N021 1/20 0.42
ALKBH5 Q6P6C2 1/20 0.42

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
SCHEMBL30527973 0.83 KDM4C (0.61) KDM1AHDAC1HDAC6KDM4EKDM5C
SCHEMBL40395 0.83 KDM4C (0.61) KDM1AHDAC1HDAC6KDM4EKDM5C
Hydrochloric Acid SCHEMBL29188716 0.82 KDM4C (0.59) KDM1AHDAC1HDAC6KDM4EKDM5C
SCHEMBL28786825 0.81 LMNA (0.47) KDM1AHDAC1HDAC6KDM4EKDM5C
Formaldehyde SCHEMBL27828603 0.80 KDM4C (0.57) KDM1AHDAC1HDAC6KDM4EKDM5C
SCHEMBL25524262 0.79 KDM1A (0.40) KDM1AHDAC1HDAC6KDM4EKDM5C
SCHEMBL9953768 0.78 CES1 (0.55) KDM1AHDAC1HDAC6KDM4CALDH1A1
SCHEMBL31026889 0.78 PARP1 (0.48) KDM1AHDAC1HDAC6KDM4EKDM5C
SCHEMBL1137138 0.78 KDM1A (0.44) KDM1AHDAC1HDAC6KDM4EKDM5C
SCHEMBL3127472 0.78 PARP1 (0.48) KDM1AHDAC1HDAC6KDM4EKDM5C

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN claimed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO claimed
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN disclosed
US-20240284907-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2024-08-29 US disclosed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 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-20240284907-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES DDT, DDC, GLUL KDM1A 511/4885HDAC1 4350/4885HDAC6 3779/4885

“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.