SCHEMBL27201854

SCHEMBL27201854

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.39
TAS2R14 Q9NYV8 6/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
HCRTR2 O43614 1/20 0.34
KDM1A O60341 2/20 0.34

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
SCHEMBL27207282 1.00 GLA (0.39) GLATAS2R14MEN1KMT2AL3MBTL1
SCHEMBL27201966 0.90 TAS2R14 (0.39) GLATAS2R14MEN1KMT2AL3MBTL1
SCHEMBL30689733 0.84 NR1D1 (0.35) GLATAS2R14MEN1KMT2AL3MBTL1
SCHEMBL27207157 0.81 ALDH1A1 (0.42) GLATAS2R14MEN1KMT2AL3MBTL1
SCHEMBL27202005 0.81 ALDH1A1 (0.42) GLATAS2R14MEN1KMT2AL3MBTL1
SCHEMBL30865701 0.75 JAK2 (0.35) GLATAS2R14MEN1KMT2AL3MBTL1
SCHEMBL31515234 0.68 CYP2D6 (0.46) GLAMEN1KMT2AKEAP1NFE2L2
SCHEMBL27207040 0.68 CYP3A4 (0.46) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL27201828 0.68 CYP3A4 (0.46) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL30689711 0.67 ALDH1A1 (0.36) GLATAS2R14MEN1KMT2AL3MBTL1

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
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
WO-2023244775-A1 BORON CONTAINING PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS AND USES THEREOF Boehringer Ingelheim Animal Health USA Inc. (US) 2023-12-21 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 (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 GLA 4349/4885TAS2R14 2918/4885MEN1 2028/4885

“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.