SCHEMBL30865701

SCHEMBL30865701

Cc1ccc(S(=O)(=O)N(C(=O)OC(C)(C)C)[C@@H]2COCC[C@H]2C#N)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.35
JAK1 P23458 6/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
NR1D1 P20393 1/20 0.34
GLA P06280 1/20 0.33
STAT5B P51692 2/20 0.33
STAT3 P40763 1/20 0.33
F2 P00734 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
FPR1 P21462 1/20 0.32
KDM1A O60341 2/20 0.32
MMP13 P45452 1/20 0.32
MMP2 P08253 1/20 0.31
ANPEP P15144 1/20 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
SCHEMBL30689733 0.91 NR1D1 (0.35) L3MBTL1NR1D1GLASTAT5BSTAT3
SCHEMBL30689711 0.85 ALDH1A1 (0.36) L3MBTL1NR1D1GLASTAT5BSTAT3
SCHEMBL27201966 0.85 TAS2R14 (0.39) JAK2JAK1L3MBTL1GLATAS2R14
SCHEMBL27207282 0.75 GLA (0.39) L3MBTL1GLATAS2R14MEN1KMT2A
SCHEMBL27201854 0.75 GLA (0.39) L3MBTL1GLATAS2R14MEN1KMT2A
SCHEMBL4367433 0.73 STAT5B (0.39) L3MBTL1NR1D1STAT5BSTAT3F2
SCHEMBL9114934 0.73 STAT5B (0.39) L3MBTL1NR1D1STAT5BSTAT3F2
SCHEMBL27207157 0.69 ALDH1A1 (0.42) L3MBTL1GLATAS2R14MEN1KMT2A
SCHEMBL27202005 0.69 ALDH1A1 (0.42) L3MBTL1GLATAS2R14MEN1KMT2A
SCHEMBL30689723 0.69 NFKB1 (0.47) GLAMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119343143-A Boron-containing pyrimidine compounds, compositions containing them, methods and uses thereof 博拉公司 2025-01-21 CN disclosed
US-20240132525-A1 BORON CONTAINING PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS AND USES THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2024-04-25 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 (1 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-20240132525-A1 BORON CONTAINING PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS AND USES THEREOF JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885L3MBTL1 1905/4885

“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.