SCHEMBL833215

SCHEMBL833215

CCC(C(=O)O)S(=O)(=N[Si](C)(C)C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.38
PSIP1 O75475 1/20 0.38
NR1I2 O75469 4/20 0.37
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
CCR5 P51681 1/20 0.33
ABCB1 P08183 1/20 0.33
ABCC1 P33527 1/20 0.33
KCNA5 P22460 1/20 0.33
RORA P35398 1/20 0.33
RORC P51449 1/20 0.33
RORB Q92753 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
MMP1 P03956 1/20 0.33
MMP7 P09237 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33

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
SCHEMBL1476455 1.00 HSD11B1 (0.38) HSD11B1PSIP1NR1I2POLBL3MBTL1
SCHEMBL1700880 0.75 MMP2 (0.50) HSD11B1PSIP1MMP2MMP9MMP1
Hydrochloric Acid SCHEMBL5120935 0.74 MMP2 (0.49) HSD11B1PSIP1MMP2MMP9MMP1
SCHEMBL835333 0.72 PSIP1 (0.44) HSD11B1PSIP1L3MBTL1MMP2MMP9
SCHEMBL835334 0.72 PSIP1 (0.44) HSD11B1PSIP1L3MBTL1MMP2MMP9
SCHEMBL1476603 0.72 PSIP1 (0.44) HSD11B1PSIP1L3MBTL1MMP2MMP9
SCHEMBL836172 0.71 HSD11B1 (0.42) HSD11B1PSIP1POLBMMP2MMP7
SCHEMBL836279 0.71 EGFR (0.49) POLB
SCHEMBL6438864 0.70 PSIP1 (0.48) HSD11B1PSIP1NR1I2POLBABCB1
SCHEMBL12750891 0.68 HSD11B1 (0.48) HSD11B1

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-8143410-B2 Kinase inhibitors ALLERGAN, INC. (US) 2012-03-27 US disclosed
US-7915443-B2 Sulfoximines as kinase inhibitors ALLERGAN, INC. (US) 2011-03-29 US disclosed
US-20090099181-A1 SULFOXIMINES AS KINASE INHIBITORS ALLERGAN, INC. 2009-04-16 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-20090099181-A1 SULFOXIMINES AS KINASE INHIBITORS SRC, PTK2B, TYRO3 HSD11B1 3429/4885PSIP1 2880/4885NR1I2 3152/4885

“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.