SCHEMBL26569860

SCHEMBL26569860

CC(C)(C)c1cccc(S(=O)(=O)F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.49
HDAC8 Q9BY41 2/20 0.44
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
EGFR P00533 1/20 0.43
TNNI3K Q59H18 1/20 0.43
CA2 P00918 4/20 0.43
CA1 P00915 3/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
PLA2G1B P04054 1/20 0.40

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
SCHEMBL5181504 0.83 LMNA (0.53) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL798087 0.82 KIF11 (0.50) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL4616498 0.82 CA1 (0.62) CA2CA1MMP1MMP2MMP9
SCHEMBL10145039 0.81 ACHE (0.50) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL10145034 0.81 RAB9A (0.51) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL12025007 0.80 CA2 (0.61) HDAC8HDAC4HDAC2CA2CA1
SCHEMBL31678755 0.80 ALDH1A1 (0.52) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL2217011 0.80 ALDH1A1 (0.46) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL7427764 0.80 ALDH1A1 (0.52) ACHEHDAC8HDAC4HDAC2HDAC3
SCHEMBL10034524 0.80 ALDH1A1 (0.59) ACHEHDAC8HDAC4HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117051414-A Method for electrochemically synthesizing aryl sulfonyl fluoride compound 常州工学院 2023-11-14 CN claimed
CN-117051414-A Method for electrochemically synthesizing aryl sulfonyl fluoride compound 常州工学院 2023-11-14 CN disclosed
US-20230331721-A1 POTENT AND SELECTIVE COVALENT INHIBITORS OF SERINE-ARGININE PROTEIN KINASE (SRPK) 1 AND SRPK2 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-19 US disclosed
US-20230331721-A1 POTENT AND SELECTIVE COVALENT INHIBITORS OF SERINE-ARGININE PROTEIN KINASE (SRPK) 1 AND SRPK2 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-19 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-20230331721-A1 POTENT AND SELECTIVE COVALENT INHIBITORS OF SERINE-ARGININE PROTEIN KINASE (SRPK) 1 AND SRPK2 AND USES THEREOF SRPK1, SRPK2, SRPK3 ACHE 4283/4885HDAC8 2054/4885HDAC4 2855/4885

“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.