SCHEMBL25319929

SCHEMBL25319929

O=[N+]([O-])c1cc(Cl)ccc1-n1cc(I)nn1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 5/20 0.50
▸ ALDH1A1 P00352 5/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ TRPV1 Q8NER1 1/20 0.46
▸ LMNA P02545 6/20 0.43
▸ MAPT P10636 5/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ POLB P06746 3/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NOTUM Q6P988 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ VCAM1 P19320 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ KCNMA1 Q12791 1/20 0.39
▸ HTT P42858 2/20 0.39
▸ MDM2 Q00987 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
SCHEMBL25321511 0.86 MAPK1 (0.52) MAPK1ALDH1A1L3MBTL1TRPV1LMNA
SCHEMBL25323110 0.82 MAPK1 (0.49) MAPK1ALDH1A1L3MBTL1TRPV1LMNA
SCHEMBL25319625 0.80 MAPK1 (0.47) MAPK1ALDH1A1L3MBTL1TRPV1LMNA
SCHEMBL29957683 0.74 ALDH1A1 (0.52) MAPK1ALDH1A1L3MBTL1LMNAMAPT
SCHEMBL23466439 0.74 ALDH1A1 (0.52) MAPK1ALDH1A1L3MBTL1LMNAMAPT
SCHEMBL25319835 0.72 TSHR (0.46) MAPK1ALDH1A1L3MBTL1TRPV1LMNA
SCHEMBL29758132 0.71 MAPT (0.65) MAPK1ALDH1A1L3MBTL1MAPTMEN1
SCHEMBL7445704 0.71 MAPT (0.65) MAPK1ALDH1A1L3MBTL1MAPTMEN1
SCHEMBL25259166 0.70 MAPK1 (0.54) MAPK1ALDH1A1L3MBTL1LMNAMAPT
SCHEMBL25319466 0.69 TSHR (0.45) ALDH1A1L3MBTL1LMNAMAPTMEN1

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-116348109-B Piperazine derivative, and preparation method and application thereof 浙江海正药业股份有限公司 2025-01-21 — — CN disclosed
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 — — US disclosed
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 — — US disclosed
EP-4215525-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) 2023-07-26 — — EP disclosed
CN-116348109-A Piperazine derivative, and preparation method and application thereof 浙江海正药业股份有限公司 2023-06-27 — — CN 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-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF F7, F11, HABP2 MAPK1 1433/4885ALDH1A1 1218/4885L3MBTL1 4402/4885

“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.

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