SCHEMBL6843044

SCHEMBL6843044

CC(=O)c1ccc(-c2ccc(B(O)OC(C)(C)C(C)(C)O)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
HSD17B1 P14061 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KIF11 P52732 1/20 0.37
HPGD P15428 2/20 0.37
RAB9A P51151 1/20 0.37
XDH P47989 2/20 0.36
LMNA P02545 2/20 0.35
STS P08842 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
ESRRA P11474 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33

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
SCHEMBL6612175 0.87 MKNK1 (0.39) KMT2A
SCHEMBL6606360 0.84 ERN1 (0.42) MAPTSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL6610483 0.84 HPGD (0.41) SMN1; SMN2HPGD
SCHEMBL135488 0.83 TP53 (0.40) SMN1; SMN2HPGDKMT2A
SCHEMBL1832033 0.81 PARP10 (0.41) MAPTKMT2AMEN1L3MBTL1
SCHEMBL6609673 0.81 ESR1 (0.38) HSD17B1KIF11HPGDLMNAKMT2A
SCHEMBL15225532 0.81 MGLL (0.47) MAPTSMN1; SMN2LMNA
SCHEMBL473743 0.80 CA1 (0.44) MAPTHPGDRAB9AXDHSTS
SCHEMBL6840781 0.80 SCN9A (0.47)
SCHEMBL16277904 0.79 CA12 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 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-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors TNF, MMP9, MMP1 MAPT 2566/4885HSD17B1 968/4885SMN1; SMN2 1918/4885

“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.