SCHEMBL5166650

SCHEMBL5166650

CCCCCC(=O)OC(NC(=O)OC(C)(C)C)[C@H](C)C=Cc1cccs1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.43
MAPT P10636 2/20 0.40
HTT P42858 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
KMT2A Q03164 2/20 0.38
CTSS P25774 2/20 0.37
CTSL P07711 1/20 0.37
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL5167546 0.81 CTSK (0.35) CTSKHRH2HRH1LMNA
SCHEMBL5168961 0.79 CTSK (0.52) CTSKMAPTCTSSCTSLSMN1; SMN2
SCHEMBL5166030 0.78 LMNA (0.48) CTSKMAPTLMNA
SCHEMBL5165596 0.72 MAPT (0.47) CTSKMAPTCTSSLMNA
SCHEMBL5166302 0.71 CTSK (0.43) CTSKMAPTCTSSLMNA
SCHEMBL5168968 0.69 CTSK (0.43) CTSKMAPTCTSSCTSLHRH2
SCHEMBL5168987 0.69 CTSK (0.36) CTSKHRH2HRH1
SCHEMBL5167202 0.69 MAPT (0.46) CTSKMAPTKMT2ACTSSLMNA
SCHEMBL28853131 0.68 CTSK (0.47) CTSKTAS1R3TAS1R1KMT2ACTSS
SCHEMBL14743637 0.68 CTSK (0.47) CTSKTAS1R3TAS1R1KMT2ACTSS

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300405-B1 AMINO ALCOHOL DERIVATIVES SANKYO CO (JP) 2007-04-18 EP disclosed
US-6964976-B2 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2005-11-15 US disclosed
US-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 US disclosed
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed
US-20030236297-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2003-12-25 US disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 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 (2 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-20030236297-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A CTSK 4419/4885MAPT 4611/4885HTT 4785/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A CTSK 4419/4885MAPT 4611/4885HTT 4785/4885

“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.