SCHEMBL21672284

SCHEMBL21672284

O=C1COc2cc(Nc3nc(Cl)ccc3[N+](=O)[O-])ccc2N1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.48
▸ IDH1 O75874 1/20 0.42
▸ SYK P43405 4/20 0.42
▸ HSF1 Q00613 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ FGFR4 P22455 1/20 0.41
▸ P2RX3 P56373 1/20 0.40
▸ GABRG2 P18507 1/20 0.40
▸ GABRB3 P28472 1/20 0.40
▸ GABRA5 P31644 1/20 0.40
▸ BCL6 P41182 2/20 0.39
▸ BCOR Q6W2J9 2/20 0.39
▸ TNIK Q9UKE5 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.37
▸ CYP11B1 P15538 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37

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
SCHEMBL18188125 0.82 BCL6 (0.54) KIF11SYKHSF1FGFR4BCL6
SCHEMBL29393260 0.79 PRMT1 (0.48) CYP3A4CYP2C9FGFR4MAPT
SCHEMBL11560330 0.79 PRMT1 (0.48) CYP3A4CYP2C9FGFR4MAPT
SCHEMBL6789738 0.73 HSF1 (0.72) HSF1FGFR4MAPT
SCHEMBL6789725 0.73 HSF1 (0.59) HSF1CYP3A4CYP2C9FGFR4MAPT
SCHEMBL656243 0.72 SYK (0.56) KIF11IDH1SYKCYP3A4CYP19A1
SCHEMBL22719050 0.71 MAPT (0.54) HSF1CYP3A4CYP2C9FGFR4MAPT
SCHEMBL29535826 0.71 MAPT (0.54) HSF1CYP3A4CYP2C9FGFR4MAPT
SCHEMBL9984822 0.71 FGFR4 (0.52) HSF1FGFR4MAPTBRD4
SCHEMBL31561886 0.70 MKNK1 (0.46) HSF1FGFR4P2RX3MAPTBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12528810-B2 Small molecule inhibitors of DYRK/CLK and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2026-01-20 — — US disclosed
US-20250051325-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2025-02-13 — — US disclosed
US-12054483-B2 Small molecule inhibitors of DYRK/CLK and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2024-08-06 — — US disclosed
US-20220041590-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2022-02-10 — — US disclosed
CN-113164476-A Small molecule inhibitor of DYRK1/CLK and application thereof 代表亚利桑那大学的亚利桑那校董会 2021-07-23 — — CN disclosed
US-20200039989-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2020-02-06 — — 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 (5 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-12528810-B2 Small molecule inhibitors of DYRK/CLK and uses thereof CLK3, CLK2, CLK1 KIF11 3987/4885IDH1 673/4885SYK 824/4885
US-20200039989-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF CLK2, CLK1, CLK3 KIF11 2926/4885IDH1 1341/4885SYK 1457/4885
US-20220041590-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF CLK2, CLK1, CLK3 KIF11 2926/4885IDH1 1341/4885SYK 1457/4885
US-12054483-B2 Small molecule inhibitors of DYRK/CLK and uses thereof CLK2, CLK1, CLK3 KIF11 2926/4885IDH1 1341/4885SYK 1457/4885
US-20250051325-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF CLK2, CLK1, CLK3 KIF11 2926/4885IDH1 1341/4885SYK 1457/4885

“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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