SCHEMBL25006066

SCHEMBL25006066

CN(C)CCNC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.61
▸ MEN1 O00255 5/20 0.56
▸ KMT2A Q03164 5/20 0.56
▸ PAX8 Q06710 4/20 0.56
▸ LMNA P02545 6/20 0.54
▸ MAPT P10636 5/20 0.54
▸ HTT P42858 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ MITF O75030 4/20 0.53
▸ GAA P10253 2/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ MAPK1 P28482 2/20 0.52
▸ STING1 Q86WV6 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.48
▸ POLB P06746 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48

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
SCHEMBL22822784 0.89 JAK2 (0.58) JAK2MEN1KMT2APAX8LMNA
SCHEMBL25005417 0.86 JAK2 (0.67) JAK2MEN1KMT2APAX8LMNA
SCHEMBL25005574 0.83 JAK2 (0.64) JAK2MEN1KMT2APAX8LMNA
SCHEMBL24291456 0.83 LMNA (0.71) JAK2MEN1KMT2APAX8LMNA
SCHEMBL22804227 0.83 JAK2 (0.69) JAK2MEN1KMT2APAX8LMNA
SCHEMBL22822605 0.82 JAK2 (0.72) JAK2MEN1KMT2APAX8LMNA
SCHEMBL29462179 0.82 JAK2 (0.72) JAK2MEN1KMT2APAX8LMNA
SCHEMBL22804228 0.82 JAK2 (0.75) JAK2MEN1KMT2APAX8LMNA
SCHEMBL25005925 0.80 EPHX2 (0.63) JAK2MEN1KMT2APAX8LMNA
SCHEMBL22804226 0.80 JAK2 (0.67) JAK2MEN1KMT2APAX8LMNA

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-112107568-B Diaryl amide compound and application thereof 北京龙嘉博创医药科技有限公司 2022-03-25 — — CN claimed
CN-112107568-A Diaryl amide compound and application thereof 北京大学 2020-12-22 — — CN claimed
US-20230045031-A1 Diarylamide Compound and Application Thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2023-02-09 — — US disclosed
CN-112107568-B Diaryl amide compound and application thereof 北京龙嘉博创医药科技有限公司 2022-03-25 — — CN disclosed
CN-112107568-A Diaryl amide compound and application thereof 北京大学 2020-12-22 — — 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-20230045031-A1 Diarylamide Compound and Application Thereof SLC14A1, SLC28A1, SLC28A2 JAK2 3981/4885MEN1 3485/4885KMT2A 3036/4885

“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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