SCHEMBL23255809

SCHEMBL23255809

O=[N+]([O-])c1ccc(Oc2c(I)cc([N+](=O)[O-])cc2I)c(I)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
TDP1 Q9NUW8 2/20 0.44
HSPB1 P04792 4/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.42
PDE7A Q13946 1/20 0.41
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
XDH P47989 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 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
SCHEMBL23255814 0.89 HSPB1 (0.49) MEN1KMT2ALMNAHTTTDP1
SCHEMBL23255815 0.83 LMNA (0.59) MEN1KMT2ALMNAHTTTDP1
SCHEMBL21904973 0.81 HSPB1 (0.45) MEN1KMT2ALMNAHTTTDP1
SCHEMBL38657150 0.79 TDP1 (0.64) MEN1KMT2ALMNAHTTTDP1
SCHEMBL17467709 0.79 TDP1 (0.46) MEN1KMT2ALMNAHTTTDP1
SCHEMBL1027041 0.79 TDP1 (0.64) MEN1KMT2ALMNAHTTTDP1
SCHEMBL21904840 0.76 HSPB1 (0.72) MEN1KMT2ALMNAHTTTDP1
SCHEMBL12573344 0.76 SNCA (0.47) MEN1KMT2ALMNAHTTTDP1
SCHEMBL4962536 0.75 MAPT (0.55) MEN1KMT2ALMNAHTTTDP1
SCHEMBL28003798 0.75 MEN1 (0.46) MEN1KMT2ALMNAHTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024481-B1 Bis(aniline) compounds containing multiple substituents with carbon-carbon triple-bonded groups UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2024-07-02 US disclosed
US-11608310-B1 Bis(aniline) compounds containing multiple substituents with carbon-carbon triple-bonded groups UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2023-03-21 US disclosed
US-10988437-B1 Bis(aniline) compounds containing multiple substituents with carbon-carbon triple-bonded groups UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2021-04-27 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 (3 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-10988437-B1 Bis(aniline) compounds containing multiple substituents with carbon-carbon triple-bonded groups PARN, PARG, PARP14 MEN1 3653/4885KMT2A 505/4885LMNA 318/4885
US-11608310-B1 Bis(aniline) compounds containing multiple substituents with carbon-carbon triple-bonded groups PARN, PARG, PARP14 MEN1 3653/4885KMT2A 505/4885LMNA 318/4885
US-12024481-B1 Bis(aniline) compounds containing multiple substituents with carbon-carbon triple-bonded groups PARN, PARG, PARP14 MEN1 3653/4885KMT2A 505/4885LMNA 318/4885

“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.