SCHEMBL21990463

SCHEMBL21990463

COC(=O)c1nccc2c1CN(C(=O)OC(C)(C)C)C2=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.38
GABRA1 P14867 8/20 0.37
GABRG2 P18507 8/20 0.37
GABRB3 P28472 8/20 0.37
GABRA5 P31644 8/20 0.37
GABRA3 P34903 8/20 0.37
GABRA6 Q16445 8/20 0.37
ATR Q13535 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
GABRA2 P47869 5/20 0.36
GABRB2 P47870 2/20 0.36
PIK3CA P42336 2/20 0.35
MTOR P42345 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL18789182 0.81 POLB (0.44) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL21990479 0.79 PIK3CA (0.36) NR1H2GABRA1GABRG2GABRB3GABRA5
SCHEMBL21990607 0.78 NR1H2 (0.37) NR1H2GABRA1GABRG2GABRB3GABRA5
SCHEMBL18789177 0.74 PIK3CA (0.46) PIK3CAMTOR
SCHEMBL22012606 0.74 SSTR4 (0.36) PIK3CAMTOR
SCHEMBL29814890 0.73 CAMKK1 (0.36)
SCHEMBL21847830 0.73 NR1H2 (0.34) NR1H2HDAC1HDAC6PIK3CAMTOR
SCHEMBL30701033 0.72 BUB1 (0.43) PIK3CAMTOR
SCHEMBL30233716 0.71 MAP4K1 (0.35) NR1H2ATRHDAC1HDAC6PIK3CA
SCHEMBL24001751 0.71 UCHL1 (0.45) NR1H2HDAC1HDAC6

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
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-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 (2 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-20200172539-A1 Azalactam Compounds as HPK1 Inhibitors CDKN1A, HIPK1, CMPK1 NR1H2 2755/4885GABRA1 4139/4885GABRG2 4229/4885
US-11142525-B2 Azalactam compounds as HPK1 inhibitors CDKN1A, HIPK1, CMPK1 NR1H2 2755/4885GABRA1 4139/4885GABRG2 4229/4885

“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.