SCHEMBL836447

SCHEMBL836447

CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)OC

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.52
BTK Q06187 1/20 0.52
CTSK P43235 12/20 0.51
CTSS P25774 8/20 0.51
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CAPN1 P07384 1/20 0.38

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
SCHEMBL6631742 1.00 JAK3 (0.52) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL836446 1.00 JAK3 (0.52) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL418755 0.88 JAK3 (0.56) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL837298 0.88 JAK3 (0.56) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL31393677 0.88 JAK3 (0.56) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL8228461 0.88 JAK3 (0.52) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL747074 0.88 JAK3 (0.52) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL3745068 0.88 JAK3 (0.52) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL24856016 0.86 JAK3 (0.51) JAK3BTKCTSKCTSSCYP1A2
SCHEMBL8382498 0.86 JAK3 (0.51) JAK3BTKCTSKCTSSCYP1A2

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300936-A1 PREPARATION OF SUBSTITUTED 1,2-DIAMINOHETEROCYCLIC COMPOUND DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS AVELOS THERAPEUTICS INC. (KR) 2024-09-12 US disclosed
US-20240197703-A1 Azalactam Compounds as HPK1 Inhibitors PFIZER INC. (US) 2024-06-20 US disclosed
EP-4352049-A1 PREPARATION OF SUBSTITUTED 1,2-DIAMINOHETEROCYCLIC COMPOUND DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS Avelos Therapeutics Inc. (KR) 2024-04-17 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-20230167068-A1 BENZOPYRAZOLE COMPOUND MEDSHINE DISCOVERY INC. (CN) 2023-06-01 US disclosed
WO-2023057882-A1 COMBINATIONS OF AZALACTAM COMPOUNDS WITH A PD-1 AXIS BINDING ANTAGONIST FOR THE TREATMENT OF CANCER PFIZER INC. (US) 2023-04-13 WO disclosed
EP-4143186-A1 AZALACTAM COMPOUNDS AS HPK1 INHIBITORS Pfizer Inc. (US) 2023-03-08 EP disclosed
CN-115698004-A Azalactam compounds as HPK1 inhibitors 辉瑞公司 2023-02-03 CN disclosed
US-20100197644-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 US disclosed
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 US disclosed
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 US disclosed
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 US disclosed
US-20080214641-A1 Chemical compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
US-20080214641-A1 Chemical compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
US-20080214641-A1 Chemical compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
WO-2008076048-A1 INDAZOLYL ESTER AND AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
US-6018020-A VIRICIDES WHICH ARE PROTEASE INHIBITORS AGAINST HEPATITIS C AND HEPATITIS G HOFFMAN-LA ROCHE INC. (US) 2000-01-25 US disclosed
US-5866684-A Peptidyl inhibitors of viral proteases HOFFMANN-LA ROCHE INC. (US) 1999-02-02 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 (6 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-20080214641-A1 Chemical compounds 572 ABCG2, ABCB1, CYP11B2 JAK3 3057/4885BTK 2952/4885CTSK 659/4885
US-20230167068-A1 BENZOPYRAZOLE COMPOUND ABCB1, CYP3A43, CYP3A5 JAK3 475/4885BTK 248/4885CTSK 955/4885
US-20100197644-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 JAK3 3057/4885BTK 2952/4885CTSK 659/4885
US-11684616-B2 Azalactam compounds as HPK1 inhibitors CDKN1A, HIPK1, CMPK1 JAK3 1153/4885BTK 1835/4885CTSK 908/4885
US-20240300936-A1 PREPARATION OF SUBSTITUTED 1,2-DIAMINOHETEROCYCLIC COMPOUND DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS MAST1, MAST3, MAST4 JAK3 795/4885BTK 405/4885CTSK 580/4885
US-20240197703-A1 Azalactam Compounds as HPK1 Inhibitors CDKN1A, HIPK1, CMPK1 JAK3 1153/4885BTK 1835/4885CTSK 908/4885

“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.