SCHEMBL6609673

SCHEMBL6609673

CC(C)(O)C(C)(C)OB(O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.38
ESR2 Q92731 4/20 0.38
ENPP2 Q13822 1/20 0.38
ABL1 P00519 2/20 0.34
ABCB1 P08183 2/20 0.34
BCR P11274 2/20 0.34
KIF11 P52732 1/20 0.33
MMP3 P08254 1/20 0.33
BCL2L1 Q07817 1/20 0.33
HSD17B1 P14061 1/20 0.32
LMNA P02545 1/20 0.32
TYR P14679 1/20 0.32
CYP3A4 P08684 1/20 0.32
AR P10275 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
HTR6 P50406 1/20 0.32
ESRRG P62508 1/20 0.32

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
SCHEMBL1181137 0.95 ENPP2 (0.41) ESR1ESR2ENPP2LMNATYR
SCHEMBL15225532 0.86 MGLL (0.47) MMP3BCL2L1LMNATSHRCA1
SCHEMBL16334163 0.83 KIF11 (0.42) KIF11LMNACYP3A4ERN1
SCHEMBL6607206 0.82 PPARG (0.34) KIF11ERN1
SCHEMBL19433226 0.82 CA2 (0.42) ENPP2TSHRCA1CA2MGLL
SCHEMBL6607392 0.81 ATM (0.35) ERN1
SCHEMBL6843044 0.81 MAPT (0.43) KIF11HSD17B1LMNAHPGDSLC6A3
SCHEMBL3681691 0.80 CA2 (0.45) TSHRMEN1KMT2ACA1CA2
SCHEMBL6612175 0.80 MKNK1 (0.39) KMT2ACA1CA2ERN1
SCHEMBL1128777 0.79 ESR1 (0.36) ESR1ESR2ENPP2ABL1ABCB1

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 3 patents. 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
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP disclosed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 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-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors TNF, MMP9, MMP1 ESR1 3538/4885ESR2 1393/4885ENPP2 895/4885

“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.