SCHEMBL21990508

SCHEMBL21990508

CC(C)N(C)c1cc2c(c(CN(C)C(=O)OC(C)(C)C)n1)CNC2=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNA1C Q13936 1/20 0.35
HTR2C P28335 6/20 0.33
SLC6A4 P31645 6/20 0.33
MAP4K1 Q92918 2/20 0.31
AAK1 Q2M2I8 1/20 0.30
CYP17A1 P05093 1/20 0.30
CYP3A4 P08684 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL30227881 1.00 CACNA1G (0.35) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL30136111 0.90 CACNA1G (0.37) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL22012577 0.90 CACNA1G (0.37) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL21964196 0.85 MAP4K1 (0.33) MAP4K1
SCHEMBL22012277 0.83 CACNA1G (0.37) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL30500363 0.83 CACNA1G (0.37) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL28975061 0.83 KDM4A (0.35) CACNA1BCACNA1CMAP4K1
SCHEMBL22012609 0.82 CACNA1G (0.42) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL21990476 0.81 CACNA1G (0.38) CACNA1GCACNA1BCACNA1CHTR2CSLC6A4
SCHEMBL21990455 0.79 MAP4K1 (0.36) MAP4K1CYP17A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240197703-A1 Azalactam Compounds as HPK1 Inhibitors PFIZER INC. (US) 2024-06-20 US disclosed
EP-3880676-B1 2,3-DIHYDRO-1H-PYRROLO[3,4-C]PYRIDIN-1-ONE DERIVATIVES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER PFIZER (US) 2023-08-02 EP disclosed
EP-3880676-B1 2,3-DIHYDRO-1H-PYRROLO[3,4-C]PYRIDIN-1-ONE DERIVATIVES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER PFIZER (US) 2023-08-02 EP disclosed
US-11684616-B2 Azalactam compounds as HPK1 inhibitors PFIZER INC. (US) 2023-06-27 US disclosed
US-11684616-B2 Azalactam compounds as HPK1 inhibitors PFIZER INC. (US) 2023-06-27 US disclosed
US-11684616-B2 Azalactam compounds as HPK1 inhibitors PFIZER INC. (US) 2023-06-27 US disclosed
US-20220401424-A1 Azalactam Compounds as HPK1 Inhibitors PFIZER INC. (US) 2022-12-22 US disclosed
US-20220401424-A1 Azalactam Compounds as HPK1 Inhibitors PFIZER INC. (US) 2022-12-22 US disclosed
WO-2021220185-A1 AZALACTAM COMPOUNDS AS HPK1 INHIBITORS PFIZER INC. (US) 2021-11-04 WO disclosed
US-11142525-B2 Azalactam compounds as HPK1 inhibitors PFIZER INC. (US) 2021-10-12 US disclosed
US-11142525-B2 Azalactam compounds as HPK1 inhibitors PFIZER INC. (US) 2021-10-12 US disclosed
US-20200172539-A1 Azalactam Compounds as HPK1 Inhibitors PFIZER INC. (US) 2020-06-04 US disclosed
US-20200172539-A1 Azalactam Compounds as HPK1 Inhibitors PFIZER INC. (US) 2020-06-04 US disclosed
WO-2020100027-A1 2,3-DIHYDRO-1H-PYRROLO[3,4-C]PYRIDIN-1-ONE DERIVATIVES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER PFIZER INC. (US) 2020-05-22 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 (5 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-20220401424-A1 Azalactam Compounds as HPK1 Inhibitors CDKN1A, HIPK1, CMPK1 CACNA1G 4260/4885CACNA1B 4070/4885CACNA1C 4602/4885
US-20200172539-A1 Azalactam Compounds as HPK1 Inhibitors CDKN1A, HIPK1, CMPK1 CACNA1G 4323/4885CACNA1B 4420/4885CACNA1C 4661/4885
US-11142525-B2 Azalactam compounds as HPK1 inhibitors CDKN1A, HIPK1, CMPK1 CACNA1G 4323/4885CACNA1B 4420/4885CACNA1C 4661/4885
US-11684616-B2 Azalactam compounds as HPK1 inhibitors CDKN1A, HIPK1, CMPK1 CACNA1G 4260/4885CACNA1B 4070/4885CACNA1C 4602/4885
US-20240197703-A1 Azalactam Compounds as HPK1 Inhibitors CDKN1A, HIPK1, CMPK1 CACNA1G 4260/4885CACNA1B 4070/4885CACNA1C 4602/4885

“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.