SCHEMBL5956731

SCHEMBL5956731

C[Si](C)(C)CCOCn1ccc2c(SNC(=O)c3ccc4c(c3)OCC[C@@H]4NC(=O)OCc3ccccc3)ccnc21

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.33
TBXA2R P21731 1/20 0.32
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
HSD17B10 Q99714 1/20 0.31
AURKA O14965 1/20 0.31
FLT1 P17948 1/20 0.31
KDR P35968 1/20 0.31
FLT3 P36888 1/20 0.31
NTRK1 P04629 1/20 0.31
MAPK8 P45983 2/20 0.30
ROCK2 O75116 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30

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
SCHEMBL5956630 0.90 TBXA2R (0.34) TBXA2RHPGDRAB9AHSD17B10NTRK1
SCHEMBL5956587 0.80 JAK2 (0.43) TBXA2RROCK2JAK2JAK1TYK2
SCHEMBL5956643 0.78 DNMT1 (0.34) DGAT1AURKAFLT1KDRFLT3
SCHEMBL5956640 0.78 DNMT1 (0.34) DGAT1AURKAFLT1KDRFLT3
SCHEMBL5956732 0.77 ROCK2 (0.40) TBXA2RHPGDRAB9AHSD17B10ROCK2
SCHEMBL5956781 0.72 DGAT1 (0.32) DGAT1RAB9A
SCHEMBL5956742 0.71 IRAK4 (0.32) DGAT1
SCHEMBL5956854 0.70 TBXA2R (0.48) TBXA2RRAB9A
SCHEMBL5956658 0.70 ALDH1A1 (0.44) HPGDRAB9A
SCHEMBL5956646 0.70 POLB (0.51) RAB9AROCK2

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
EP-1270570-B1 AMIDE COMPOUNDS AND USE THEREOF MITSUBISHI PHARMA CORP (JP) 2006-05-31 EP disclosed
US-6933305-B2 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-08-23 US disclosed
US-20030158413-A1 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-08-21 US disclosed
EP-1270570-A1 AMIDE COMPOUNDS AND USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-01-02 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-20030158413-A1 Amide compounds and use thereof ROCK2, ROCK1, RHOT2 DGAT1 2691/4885TBXA2R 1428/4885HPGD 816/4885

“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.