SCHEMBL5168944

SCHEMBL5168944

C[C@@H](COC(=O)C(=O)OC[C@H](C)CC(N)c1ccc(C#CCCCc2ccccc2)s1)CC(N)c1ccc(C#CCCCc2ccccc2)s1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.34
LMNA P02545 1/20 0.33
GRIK1 P39086 1/20 0.33
PTGER4 P35408 2/20 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
SCHEMBL5168187 0.94 FFAR1 (0.36) GRM5PTGER4
SCHEMBL5167374 0.86 GRM5 (0.37) GRM5PTGER4
SCHEMBL5170465 0.86 DPP4 (0.37)
SCHEMBL6305328 0.81 ALOX5 (0.38) LMNAGRIK1
SCHEMBL5165534 0.81 LTB4R (0.39) LMNAGRIK1
SCHEMBL5168831 0.80 ALDH1A1 (0.35)
SCHEMBL5167532 0.80 TRPA1 (0.35) GRM5PTGER4
SCHEMBL5165260 0.80 NPC1 (0.39) LMNAGRIK1
SCHEMBL6306485 0.79 CES1 (0.40)
SCHEMBL5168152 0.73 LMNA (0.39) LMNAGRIK1

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 GRM5 982/4885LMNA 3703/4885GRIK1 627/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A GRM5 982/4885LMNA 3703/4885GRIK1 627/4885

“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.