SCHEMBL21678595

SCHEMBL21678595

C[Si](C)(C)CCOCn1cc(C(=O)C2CCCC2)c2c(Cl)ncnc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.36
▸ ADK P55263 4/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ DGAT1 O75907 3/20 0.34
▸ KLKB1 P03952 1/20 0.32
▸ CNR2 P34972 3/20 0.31
▸ CNR1 P21554 2/20 0.31

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
SCHEMBL21678593 0.98 ADK (0.35) TP53ADKSMN1; SMN2MAPTTHRB
SCHEMBL21678727 0.96 ADK (0.37) TP53ADKMAPTDGAT1KLKB1
SCHEMBL21678389 0.89 ADK (0.33) ADKDGAT1KLKB1CNR2CNR1
SCHEMBL31070094 0.85 TP53 (0.38) TP53SMN1; SMN2MAPTTHRBDGAT1
SCHEMBL21678521 0.85 TP53 (0.38) TP53SMN1; SMN2MAPTTHRBDGAT1
SCHEMBL31070086 0.81 DGAT1 (0.38) TP53ADKMAPTDGAT1KLKB1
SCHEMBL21678636 0.81 DGAT1 (0.38) TP53ADKMAPTDGAT1KLKB1
SCHEMBL15013944 0.81 ADK (0.39) ADKSMN1; SMN2DGAT1
SCHEMBL21678409 0.78 ADK (0.31) ADKDGAT1
SCHEMBL21678577 0.78 ADK (0.33) ADKDGAT1

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
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-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
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 TP53 2336/4885ADK 454/4885SMN1; SMN2 4492/4885
US-20200048262-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK TP53 3176/4885ADK 163/4885SMN1; SMN2 2194/4885
US-20240132505-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK TP53 3176/4885ADK 163/4885SMN1; SMN2 2194/4885
US-12297203-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK TP53 3176/4885ADK 163/4885SMN1; SMN2 2194/4885
US-20220348579-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK TP53 3176/4885ADK 163/4885SMN1; SMN2 2194/4885
US-11021482-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK TP53 3176/4885ADK 163/4885SMN1; SMN2 2194/4885
US-11820775-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK TP53 3176/4885ADK 163/4885SMN1; SMN2 2194/4885

“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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