SCHEMBL3516007

SCHEMBL3516007

Cc1ccc(S(=O)(=O)O)c(CCC2CCN(C=O)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 7/20 0.42
MMP2 P08253 6/20 0.42
MMP13 P45452 6/20 0.42
ADAM17 P78536 3/20 0.42
MMP14 P50281 3/20 0.42
HTR2A P28223 7/20 0.40
HTR2C P28335 7/20 0.40
CNR2 P34972 2/20 0.37
MMP1 P03956 1/20 0.37
ADAMTS5 Q9UNA0 4/20 0.37
MMP9 P14780 2/20 0.36
CNR1 P21554 1/20 0.36
EPHX2 P34913 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34

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
SCHEMBL348533 0.86 ADAMTS4 (0.38) ADAMTS4MMP2MMP13ADAM17MMP14
SCHEMBL5115513 0.80 NPC1 (0.38) ADAMTS4MMP2MMP13ADAM17MMP14
SCHEMBL3118465 0.76 ALDH1A1 (0.38) ADAMTS4MMP2MMP13ADAM17MMP14
SCHEMBL3125369 0.76 ADAMTS4 (0.36) ADAMTS4MMP2MMP13ADAM17MMP14
SCHEMBL3113106 0.74 ADAMTS4 (0.40) ADAMTS4MMP2MMP13ADAM17MMP14
SCHEMBL30823619 0.74 GAA (0.41) MEN1KMT2A
SCHEMBL1180196 0.74 GAA (0.41) MEN1KMT2A
SCHEMBL3516005 0.72 EPHX2 (0.34) CNR2EPHX2
SCHEMBL5718625 0.71 GAA (0.39) MEN1KMT2A
SCHEMBL30723203 0.71 GAA (0.39) MEN1KMT2A

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-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders MYRIAD PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
EP-2219448-A1 THERAPEUTIC COMPOUNDS AND THEIR USE IN TREATING DISEASES AND DISORDERS Myriad Pharmaceuticals, Inc. (US) 2010-08-25 EP disclosed
WO-2009065035-A1 THERAPEUTIC COMPOUNDS AND THEIR USE IN TREATING DISEASES AND DISORDERS MYRIAD GENETICS, INC. (US) 2009-05-22 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-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders VHL, CLN6, CFTR ADAMTS4 577/4885MMP2 3089/4885MMP13 416/4885

“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.