SCHEMBL21701263

SCHEMBL21701263

CC(C)(C)OC(=O)N1CCC[C@@H](Nc2ncnc3c2c(C(=O)C2CCCC2)cn3COCC[Si](C)(C)C)C1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 1/20 0.43
▸ BTK Q06187 2/20 0.43
▸ PIK3CD O00329 3/20 0.39
▸ JAK3 P52333 12/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ HDAC4 P56524 1/20 0.35
▸ HDAC6 Q9UBN7 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
SCHEMBL21701261 0.98 ADORA1 (0.44) ADORA1BTKPIK3CDJAK3PIK3CA
SCHEMBL21701272 0.92 ADORA1 (0.41) ADORA1BTKPIK3CDJAK3PIK3CA
SCHEMBL21678634 0.91 ADORA1 (0.42) ADORA1BTKPIK3CDPIK3CA
SCHEMBL21678762 0.90 JAK3 (0.40) JAK3
SCHEMBL21678758 0.90 JAK3 (0.40) JAK3
SCHEMBL21701291 0.88 ADORA1 (0.42) ADORA1BTKPIK3CDJAK3PIK3CA
SCHEMBL16764665 0.88 ADORA1 (0.44) ADORA1BTKPIK3CDJAK3PIK3CA
SCHEMBL16764667 0.88 ADORA1 (0.44) ADORA1BTKPIK3CDJAK3PIK3CA
SCHEMBL16785957 0.88 ADORA1 (0.44) ADORA1BTKPIK3CDJAK3PIK3CA
SCHEMBL16765684 0.88 ADORA1 (0.44) ADORA1BTKPIK3CDJAK3PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260035373-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ACLARIS THERAPEUTICS INC (US) 2026-02-05 — — US disclosed
US-12297203-B2 Pyrrolopyrimidine ITK inhibitors ACLARIS THERAPEUTICS, INC. (US) 2025-05-13 — — US disclosed
CN-119080779-A Pyrrolopyrimidine ITK inhibitors 阿克拉瑞斯治疗股份有限公司 2024-12-06 — — CN disclosed
CN-112823005-B Pyrrolopyrimidine ITK inhibitors 阿克拉瑞斯治疗股份有限公司 2024-08-20 — — CN disclosed
US-20240132505-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ACLARIS THERAPEUTICS, INC. 2024-04-25 — — US disclosed
US-11820775-B2 Pyrrolopyrimidine ITK inhibitors ACLARIS THERAPEUTICS, INC. (US) 2023-11-21 — — US disclosed
US-11820775-B2 Pyrrolopyrimidine ITK inhibitors ACLARIS THERAPEUTICS, INC. (US) 2023-11-21 — — US disclosed
US-11820775-B2 Pyrrolopyrimidine ITK inhibitors ACLARIS THERAPEUTICS, INC. (US) 2023-11-21 — — US disclosed
US-20220348579-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ACLARIS THERAPEUTICS, INC. 2022-11-03 — — US disclosed
US-11021482-B2 Pyrrolopyrimidine ITK inhibitors Adaris Therapeutics, Inc. (US) 2021-06-01 — — US disclosed
US-20200048262-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ACLARIS THERAPEUTICS, INC. 2020-02-13 — — US disclosed
WO-2020033955-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ACLARIS THERAPEUTICS, INC. (US) 2020-02-13 — — 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 (7 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-20260035373-A1 PYRROLOPYRIMIDINE ITK INHIBITORS JAK3, JAK1, JAK2 ADORA1 1530/4885BTK 46/4885PIK3CD 943/4885
US-20200048262-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK ADORA1 3880/4885BTK 558/4885PIK3CD 1068/4885
US-20240132505-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK ADORA1 3880/4885BTK 558/4885PIK3CD 1068/4885
US-12297203-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK ADORA1 3880/4885BTK 558/4885PIK3CD 1068/4885
US-20220348579-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK ADORA1 3880/4885BTK 558/4885PIK3CD 1068/4885
US-11021482-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK ADORA1 3880/4885BTK 558/4885PIK3CD 1068/4885
US-11820775-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK ADORA1 3880/4885BTK 558/4885PIK3CD 1068/4885

“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.

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