SCHEMBL24242561

SCHEMBL24242561

C[C@@H](CO)NS(=O)(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 11/20 0.65
MMP13 P45452 6/20 0.65
AR P10275 5/20 0.56
ALDH1A1 P00352 3/20 0.56
POLB P06746 2/20 0.56
MMP1 P03956 1/20 0.55
MMP2 P08253 1/20 0.55
MMP9 P14780 1/20 0.55
MMP14 P50281 1/20 0.55
ADAM17 P78536 1/20 0.55
ADAMTS5 Q9UNA0 1/20 0.55
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA4 P22748 1/20 0.54
CA5A P35218 1/20 0.54
CA7 P43166 1/20 0.54
CA9 Q16790 1/20 0.54
CA5B Q9Y2D0 1/20 0.54

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
SCHEMBL6325732 1.00 ADAMTS4 (0.65) ADAMTS4MMP13ARALDH1A1POLB
SCHEMBL6325729 1.00 ADAMTS4 (0.65) ADAMTS4MMP13ARALDH1A1POLB
SCHEMBL31310984 0.81 SMN1; SMN2 (0.67) ADAMTS4MMP13ALDH1A1POLBMMP1
SCHEMBL31310982 0.81 SMN1; SMN2 (0.67) ADAMTS4MMP13ALDH1A1POLBMMP1
SCHEMBL6240936 0.80 ADAMTS4 (0.70) ADAMTS4MMP13MMP2MMP14ADAMTS5
SCHEMBL6323743 0.80 MMP13 (0.54) ADAMTS4MMP13ALDH1A1POLBMMP1
SCHEMBL1656170 0.79 ADAMTS4 (1.00) ADAMTS4MMP13MMP2MMP14ADAMTS5
SCHEMBL12730470 0.79 ADAMTS4 (1.00) ADAMTS4MMP13MMP2MMP14ADAMTS5
SCHEMBL17286587 0.79 ADAMTS4 (0.62) ADAMTS4MMP13ARALDH1A1POLB
SCHEMBL6325735 0.79 ADAMTS4 (0.62) ADAMTS4MMP13ARPOLBMMP1

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
CN-118221656-A Compounds useful for the treatment of gastrointestinal disorders 阿德利克斯股份有限公司 2024-06-21 CN disclosed
CN-110267944-B Compounds useful for the treatment of gastrointestinal disorders 阿德利克斯股份有限公司 2024-03-08 CN disclosed
US-11242337-B2 Compounds useful for treating gastrointestinal tract disorders ARDELYX, INC. (US) 2022-02-08 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-11242337-B2 Compounds useful for treating gastrointestinal tract disorders SLC10A2, FABP2, SLC10A1 ADAMTS4 3282/4885MMP13 1803/4885AR 1714/4885

“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.