SCHEMBL25257917

SCHEMBL25257917

COc1cc(Cl)c([N+](=O)[O-])cc1N1CCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 6/20 0.46
LIN28A Q9H9Z2 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 6/20 0.45
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
ENPP2 Q13822 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
HSP90AA1 P07900 1/20 0.43
GAA P10253 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL25257910 0.88 MAPT (0.51) MAPTKDM4EALDH1A1LIN28AMEN1
SCHEMBL25301725 0.81 SMN1; SMN2 (0.57) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL25296553 0.81 GRM5 (0.55) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL310278 0.81 TMEM97 (0.46) MAPTKDM4EALDH1A1PTGDR2SMN1; SMN2
SCHEMBL31017636 0.80 MAPT (0.46) MAPTKDM4EALDH1A1LIN28APTGDR2
SCHEMBL3821618 0.80 MAPT (0.56) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL3417273 0.79 MAPT (0.53) MAPTKDM4EALDH1A1LIN28AMEN1
SCHEMBL11455824 0.78 GRM5 (0.53) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL310249 0.76 SMN1; SMN2 (0.46) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL31204490 0.75 LIN28A (0.41) MAPTKDM4EALDH1A1LIN28APTGDR2

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-20240366770-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEIGENE SWITZERLAND GMBH (CH) 2024-11-07 US disclosed
CN-118414336-A Degradation of Bruton Tyrosine Kinase (BTK) by conjugation of BTK inhibitors to E3 ligase ligands and methods of use 百济神州有限公司 2024-07-30 CN disclosed
WO-2023125907-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEIGENE, LTD. (KY) 2023-07-06 WO 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-20240366770-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BTK, CBL, LYN MAPT 3793/4885KDM4E 983/4885ALDH1A1 4351/4885

“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.