SCHEMBL5166384

SCHEMBL5166384

C[C@](N)(CO)CCc1ccc(OCCCc2ccccc2)s1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.39
LTA4H P09960 2/20 0.38
LMNA P02545 1/20 0.38
FFAR1 O14842 3/20 0.37
S1PR4 O95977 2/20 0.36
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
S1PR5 Q9H228 1/20 0.36
PPARG P37231 3/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
PPARA Q07869 1/20 0.34
C5AR1 P21730 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
EPHX2 P34913 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
Cadaverine Tartrate SCHEMBL5165267 0.91 LMNA (0.37) LTA4HLMNAFFAR1S1PR4S1PR1
SCHEMBL6303133 0.84 TNNC1 (0.40) S1PR4S1PR1S1PR3S1PR5MAOA
SCHEMBL386098 0.83 TNNC1 (0.42) S1PR4S1PR1S1PR3S1PR5MAOA
SCHEMBL6309871 0.83 TNNC1 (0.42) S1PR4S1PR1S1PR3S1PR5MAOA
SCHEMBL5165299 0.82 LMNA (0.40) LMNAFFAR1S1PR4S1PR1S1PR3
SCHEMBL6305336 0.81 PPARA (0.41) LTA4HS1PR4S1PR1S1PR3S1PR5
SCHEMBL3510090 0.79 S1PR1 (0.55) LTA4HFFAR1S1PR4S1PR1S1PR3
SCHEMBL3509446 0.79 S1PR1 (0.55) LTA4HFFAR1S1PR4S1PR1S1PR3
SCHEMBL6305559 0.77 KCNA3 (0.42) LTA4HS1PR4S1PR1S1PR3S1PR5
SCHEMBL383869 0.77 L3MBTL1 (0.43) TDP1

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 IDO1 59/4885LTA4H 2372/4885LMNA 3703/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A IDO1 59/4885LTA4H 2372/4885LMNA 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.