SCHEMBL7133167

SCHEMBL7133167

COc1cc(CNCc2cccc3c2C(S(=O)(=O)c2ccccc2)CS3(O)O)cc(OC)c1OC

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM1A O60341 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
BCHE P06276 1/20 0.36

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
SCHEMBL7129574 0.91 MEN1 (0.42) KDM4EKMT2AMEN1ALDH1A1TDP1
SCHEMBL7133168 0.90 KDM4E (0.49) KDM4EKMT2AMEN1ALDH1A1TDP1
SCHEMBL7132350 0.90 KMT2A (0.47) KDM4EKMT2AMEN1ALDH1A1TDP1
SCHEMBL7693051 0.89 KMT2A (0.46) KDM4EKMT2AMEN1ALDH1A1TDP1
SCHEMBL7164364 0.89 RAB9A (0.43) KDM4EKMT2AMEN1ALDH1A1TDP1
Hydrochloric Acid SCHEMBL7160031 0.88 KMT2A (0.45) KDM4EKMT2AMEN1ALDH1A1TDP1
Hydrochloric Acid SCHEMBL7160227 0.88 RAB9A (0.43) KDM4EKMT2AMEN1ALDH1A1TDP1
SCHEMBL7133437 0.87 KMT2A (0.46) KDM4EKMT2AMEN1ALDH1A1GAA
SCHEMBL7126145 0.86 APLNR (0.46) KDM4EKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7132601 0.85 PKM (0.38) KDM4EKMT2AALDH1A1GAARAB9A

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
US-6555555-B1 Inhibitors of interleukin-6 and/or interleukin-12; for example 4,5-dimethyl-1,1-dioxidebenzo(b)thiophene; treating various inflammatory diseases, autoimmune diseases, cancer, osteoporosis ONO PHARMACEUTICAL CO., LTD. (JP) 2003-04-29 US disclosed
US-20030073706-A1 Fused thiophone derivatives and drugs containing the same as the active ingredient KONISHI MIKIO (JP) 2003-04-17 US disclosed
US-6420391-B1 PREVENTION AND/OR TREATMENT OF VARIOUS INFLAMMATORY DISEASES, SEPSIS, MULTIPLE MYELOMA, PLASMA CELL LEUKEMIA, OSTEOPOROSIS, CACHEXIA, PSORIASIS, NEPHRITIS, RENAL CELL CARCINOMA, KAPOSI'S SARCOMA, RHEUMATOID ARTHRITIS, GAMMOPATHY, CASTLEMAN'S ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
EP-1067128-A1 FUSED THIOPHENE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-01-10 EP 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-20030073706-A1 Fused thiophone derivatives and drugs containing the same as the active ingredient TPMT, CD47, THPO KDM4E 1111/4885KMT2A 3177/4885MEN1 292/4885

“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.