SCHEMBL21404432

SCHEMBL21404432

O=C(O)NCCn1cnc(I)c1I

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.44
MTNR1A P48039 3/20 0.37
MTNR1B P49286 2/20 0.37
CSNK2A2 P19784 1/20 0.34
CSNK2A1 P68400 1/20 0.34
EGLN3 Q9H6Z9 1/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
CASP1 P29466 2/20 0.31

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
SCHEMBL10454788 0.73 EGLN3 (0.66) EGLN3MAPK1LMNASMN1; SMN2L3MBTL1
SCHEMBL21404585 0.70 CPB2 (0.34)
SCHEMBL2144407 0.69 MTNR1A (0.54) MTNR1AMTNR1BEGLN3LMNASMN1; SMN2
SCHEMBL3038961 0.68 ALDH1A1 (0.51) MTNR1ASMN1; SMN2HTTKMT2A
SCHEMBL21404446 0.68 MTNR1A (0.34) MTNR1AMTNR1BMAPK1SMN1; SMN2L3MBTL1
SCHEMBL17293996 0.67 ADORA2A (0.62)
SCHEMBL21404329 0.67 ESR1 (0.39) MTNR1ALMNASMN1; SMN2HTTKMT2A
SCHEMBL21404375 0.67 MEN1 (0.34) MTNR1AMTNR1BSMN1; SMN2L3MBTL1MEN1
SCHEMBL2144935 0.66 MTNR1A (0.45) MTNR1AMTNR1BEGLN3KMT2ACASP1
SCHEMBL1397009 0.66 MTNR1A (0.45) MTNR1AMTNR1BEGLN3LMNASMN1; SMN2

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
US-20230008047-A1 IMIDAZOPIPERAZINE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-01-12 US disclosed
US-11058688-B2 Imidazopiperazine inhibitors of transcription activating proteins BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-07-13 US disclosed
EP-3773587-A1 IMIDAZOPIPERAZINE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS Board of Regents, The University of Texas System (US) 2021-02-17 EP disclosed
WO-2019191667-A1 IMIDAZOPIPERAZINE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-10-03 WO disclosed
US-20190298729-A1 IMIDAZOPIPERAZINE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-10-03 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 (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-11058688-B2 Imidazopiperazine inhibitors of transcription activating proteins EP300, CREBBP, RBBP7 CREBBP 2/4885MTNR1A 3287/4885MTNR1B 3544/4885
US-20230008047-A1 IMIDAZOPIPERAZINE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS EP300, CREBBP, RBBP7 CREBBP 2/4885MTNR1A 3287/4885MTNR1B 3544/4885
US-20190298729-A1 IMIDAZOPIPERAZINE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS EP300, CREBBP, RBBP7 CREBBP 2/4885MTNR1A 3287/4885MTNR1B 3544/4885

“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.