SCHEMBL6611235

SCHEMBL6611235

CC(C)(O)C(C)(C)OB(O)c1ccc(-c2ccc(-c3cnco3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
PKM P14618 2/20 0.45
NOTUM Q6P988 1/20 0.42
GAA P10253 1/20 0.42
IMPDH2 P12268 2/20 0.41
IMPDH1 P20839 1/20 0.41
CYP2D6 P10635 2/20 0.41
CYP3A4 P08684 1/20 0.41
PTK2 Q05397 1/20 0.41
LTA4H P09960 1/20 0.40
KEAP1 Q14145 1/20 0.39
GPR119 Q8TDV5 5/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL6607114 0.87 CYP11B1 (0.49) LMNAPKMIMPDH2IMPDH1CYP2D6
SCHEMBL6607197 0.80 IMPDH2 (0.45) IMPDH2IMPDH1GPR119
SCHEMBL6607392 0.79 ATM (0.35) GPR119HDAC3HDAC4HDAC1HDAC2
SCHEMBL16334163 0.79 KIF11 (0.42) LMNANOTUMCYP2D6CYP3A4GPR119
SCHEMBL16432264 0.77 KDM4E (0.45) GPR119KMT2AMEN1POLBKDM4E
SCHEMBL6611560 0.76 CA12 (0.42) LMNAGPR119POLBHDAC4
SCHEMBL6609803 0.76 TUBB4A (0.30)
SCHEMBL6610995 0.76 NOTUM (0.41) NOTUMGAACYP2D6GPR119KMT2A
SCHEMBL6609673 0.75 ESR1 (0.38) LMNACYP3A4KMT2AMEN1
SCHEMBL15225532 0.75 MGLL (0.47) LMNAGAANPC1CYP2C9

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 LMNA 2725/4885PKM 3258/4885NOTUM 1277/4885

“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.