SCHEMBL21037425

SCHEMBL21037425

CN(CCO)c1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.61
▸ KMT2A Q03164 8/20 0.61
▸ MAPT P10636 6/20 0.61
▸ LMNA P02545 4/20 0.61
▸ RECQL P46063 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ ALDH1A1 P00352 4/20 0.59
▸ RAB9A P51151 5/20 0.52
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ HPGD P15428 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51
▸ RELA Q04206 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ HTT P42858 1/20 0.51

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
SCHEMBL23171612 0.92 MEN1 (0.61) MEN1KMT2AMAPTLMNARECQL
SCHEMBL27983251 0.87 MEN1 (0.70) MEN1KMT2AMAPTLMNARECQL
SCHEMBL21037408 0.85 APP (0.51) MEN1KMT2AMAPTLMNARECQL
SCHEMBL21160097 0.84 MEN1 (0.47) MEN1KMT2AMAPTLMNARECQL
SCHEMBL21036839 0.84 MEN1 (0.44) MEN1KMT2AMAPTLMNARECQL
SCHEMBL5594934 0.84 MEN1 (0.65) MEN1KMT2AMAPTLMNARECQL
SCHEMBL20882975 0.84 MEN1 (0.65) MEN1KMT2AMAPTLMNARECQL
SCHEMBL24089835 0.83 MEN1 (0.52) MEN1KMT2AMAPTLMNARECQL
SCHEMBL21037454 0.82 MEN1 (0.46) MEN1KMT2AMAPTLMNARECQL
SCHEMBL27983252 0.80 MEN1 (0.82) MEN1KMT2AMAPTLMNARECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002769-A1 APTAMER NUCLEIC ACID MOLECULE, AND COMPLEX AND APPLICATION THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-01-05 — — US disclosed
US-20220214351-A1 FLUORESCENT DYE, PREPARATION METHOD AND USES THEREOF FLUORESCENCE DIAGNOSIS (SHANGHAI) BIOTECH COMPANY LTD. (CN) 2022-07-07 — — US disclosed
US-11209437-B2 Fluorescent probe and preparation method and use thereof FLUORESCENCE DIAGNOSIS (SHANGHAI) BIOTECH COMPANY (CN) 2021-12-28 — — US disclosed
WO-2021057816-A1 NUCLEIC ACID APTAMER MOLECULE 华东理工大学 2021-04-01 — — WO disclosed
US-20200248069-A1 FLUORESCENT PROBE, PREPARATION METHOD THEREFOR AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2020-08-06 — — US disclosed
US-20190187144-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-06-20 — — US disclosed
EP-3489324-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF East China University of Science and Technology (CN) 2019-05-29 — — EP 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 (4 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-20190187144-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF HNRNPF, HNRNPUL2, RAB5IF MEN1 2099/4885KMT2A 4751/4885MAPT 2624/4885
US-20230002769-A1 APTAMER NUCLEIC ACID MOLECULE, AND COMPLEX AND APPLICATION THEREOF DNTT, TIA1, TIAL1 MEN1 1182/4885KMT2A 2515/4885MAPT 2343/4885
US-20200248069-A1 FLUORESCENT PROBE, PREPARATION METHOD THEREFOR AND USE THEREOF WASF2, FAM162A, HASPIN MEN1 1100/4885KMT2A 4790/4885MAPT 3407/4885
US-11209437-B2 Fluorescent probe and preparation method and use thereof HNRNPF, HNRNPUL2, RAB5IF MEN1 2099/4885KMT2A 4751/4885MAPT 2624/4885

“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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