SCHEMBL22388259

SCHEMBL22388259

CC(C)Cc1ccnc(NC(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NR3C2 P08235 5/20 0.43
MAPK14 Q16539 6/20 0.40
MAPK10 P53779 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
IGF1R P08069 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
HTR7 P34969 1/20 0.37
FDPS P14324 1/20 0.36

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
SCHEMBL23763309 0.84 KDM4E (0.44) KDM4EPOLBSMN1; SMN2NR3C2HRH4
SCHEMBL14270718 0.84 NOS3 (0.48) KDM4ENR3C2MAPK14MAPK10HRH4
SCHEMBL2481330 0.82 RECQL (0.47) NR3C2MAPK14MAPK10HRH4IGF1R
SCHEMBL17372006 0.82 LOXL2 (0.47) NR3C2MAPK14MAPK10HRH4IGF1R
Hydrochloric Acid SCHEMBL31330323 0.81 MAPK14 (0.40) NR3C2MAPK14MAPK10HRH4IGF1R
Hydrochloric Acid SCHEMBL2302210 0.78 IGF1R (0.39) NR3C2MAPK14MAPK10HRH4IGF1R
SCHEMBL10162013 0.77 NR3C2 (0.54) NR3C2
SCHEMBL6560519 0.75 GABRA1 (0.42) KDM4EPOLBSMN1; SMN2NR3C2GABRA1
SCHEMBL25522792 0.75 HRH4 (0.39) NR3C2MAPK14MAPK10HRH4IGF1R
SCHEMBL29851369 0.73 FDPS (0.59) KDM4EPOLBSMN1; SMN2MAPK14MAPK10

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-11827656-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2023-11-28 US disclosed
US-11827656-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2023-11-28 US disclosed
US-20220073538-A1 Immunoproteasome Inhibitors PRINCIPIA BIOPHARMA INC. (US) 2022-03-10 US disclosed
US-11225493-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2022-01-18 US disclosed
US-20200277312-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2020-09-03 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 (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-11827656-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 KDM4E 1084/4885POLB 692/4885SMN1; SMN2 1377/4885
US-20200277312-A1 IMMUNOPROTEASOME INHIBITORS PSMC2, PSMB7, PSMB2 KDM4E 1084/4885POLB 692/4885SMN1; SMN2 1377/4885
US-11225493-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 KDM4E 1084/4885POLB 692/4885SMN1; SMN2 1377/4885
US-20220073538-A1 Immunoproteasome Inhibitors PSMC2, PSMB7, PSMB2 KDM4E 1084/4885POLB 692/4885SMN1; SMN2 1377/4885

“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.