SCHEMBL5165262

SCHEMBL5165262

CC(N)(CO)CCc1ccc(C#CCOc2cccc(F)c2)s1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.35
GRM5 P41594 7/20 0.35
LMNA P02545 1/20 0.31
ALOX5 P09917 2/20 0.31
MRGPRX4 Q96LA9 1/20 0.30
SSTR4 P31391 1/20 0.30
KCNH2 Q12809 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
SCHEMBL5167803 0.91 GRM5 (0.38) GRM5ALOX5
SCHEMBL5166177 0.90 DPP4 (0.34) LMNA
SCHEMBL6768936 0.89 GRM5 (0.35) EGLN1GRM5ALOX5KCNH2
SCHEMBL386989 0.89 GRM5 (0.45) EGLN1GRM5LMNA
SCHEMBL383997 0.89 ALOX5 (0.37) EGLN1GRM5ALOX5SSTR4
SCHEMBL5167592 0.88 MAOB (0.39) EGLN1LMNAALOX5MRGPRX4
SCHEMBL5166665 0.88 GRM5 (0.46) EGLN1GRM5KCNH2
SCHEMBL5169606 0.87 ALOX5 (0.36) EGLN1GRM5ALOX5
SCHEMBL5168915 0.87 KCNH2 (0.39) GRM5ALOX5KCNH2
SCHEMBL5166088 0.87 MAOB (0.34)

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 5 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-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 EGLN1 1053/4885GRM5 982/4885LMNA 3703/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A EGLN1 1053/4885GRM5 982/4885LMNA 3703/4885

“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.