SCHEMBL21678727

SCHEMBL21678727

C[Si](C)(C)CCOCn1cc(C(=O)C2CC2)c2c(Cl)ncnc21

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 6/20 0.37
▸ DGAT1 O75907 4/20 0.36
▸ FGFR1 P11362 1/20 0.33
▸ FGFR4 P22455 1/20 0.33
▸ KLKB1 P03952 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TP53 P04637 1/20 0.32

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 0.96 ADK (0.35) ADKDGAT1FGFR1FGFR4KLKB1
SCHEMBL21678595 0.96 TP53 (0.36) ADKDGAT1KLKB1MAPTTP53
SCHEMBL21678389 0.90 ADK (0.33) ADKDGAT1KLKB1
SCHEMBL31070086 0.84 DGAT1 (0.38) ADKDGAT1KLKB1NPSR1ALDH1A1
SCHEMBL21678636 0.84 DGAT1 (0.38) ADKDGAT1KLKB1NPSR1ALDH1A1
SCHEMBL15013944 0.82 ADK (0.39) ADKDGAT1ALDH1A1
SCHEMBL31070094 0.81 TP53 (0.38) DGAT1KLKB1MAPTTP53
SCHEMBL21678521 0.81 TP53 (0.38) DGAT1KLKB1MAPTTP53
SCHEMBL21678472 0.80 ADK (0.41) ADKDGAT1KLKB1
SCHEMBL31123875 0.79 DGAT1 (0.34) 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 ADK 454/4885DGAT1 4560/4885FGFR1 435/4885
US-20200048262-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK ADK 163/4885DGAT1 4090/4885FGFR1 1478/4885
US-20240132505-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK ADK 163/4885DGAT1 4090/4885FGFR1 1478/4885
US-12297203-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK ADK 163/4885DGAT1 4090/4885FGFR1 1478/4885
US-20220348579-A1 PYRROLOPYRIMIDINE ITK INHIBITORS ITK, PDXK, DMPK ADK 163/4885DGAT1 4090/4885FGFR1 1478/4885
US-11021482-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK ADK 163/4885DGAT1 4090/4885FGFR1 1478/4885
US-11820775-B2 Pyrrolopyrimidine ITK inhibitors ITK, PDXK, DMPK ADK 163/4885DGAT1 4090/4885FGFR1 1478/4885

“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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