SCHEMBL385571

SCHEMBL385571

Cn1c(CC[C@@](C)(N)CO)ccc1C(=O)CCCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.56
S1PR3 Q99500 1/20 0.56
S1PR5 Q9H228 1/20 0.56
DPP4 P27487 1/20 0.40
ACHE P22303 1/20 0.39
SGMS1 Q86VZ5 1/20 0.39
SGMS2 Q8NHU3 1/20 0.39
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
DAGLA Q9Y4D2 1/20 0.39
PLA2G4A P47712 1/20 0.39
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CES1 P23141 6/20 0.38
FAAH O00519 3/20 0.38

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
SCHEMBL384958 1.00 S1PR1 (0.56) S1PR1S1PR3S1PR5DPP4ACHE
Hydrochloric Acid SCHEMBL386151 0.99 S1PR1 (0.56) S1PR1S1PR3S1PR5DPP4ACHE
Hydrochloric Acid SCHEMBL387256 0.99 S1PR1 (0.56) S1PR1S1PR3S1PR5DPP4ACHE
SCHEMBL12743984 0.97 S1PR1 (0.60) S1PR1S1PR3S1PR5DPP4ACHE
SCHEMBL383826 0.97 S1PR1 (0.60) S1PR1S1PR3S1PR5DPP4ACHE
Hydrochloric Acid SCHEMBL388133 0.96 S1PR1 (0.59) S1PR1S1PR3S1PR5DPP4ACHE
SCHEMBL27599915 0.91 S1PR1 (0.59) S1PR1S1PR3S1PR5DPP4ACHE
Hydrochloric Acid SCHEMBL384022 0.91 S1PR1 (0.51) S1PR1S1PR3S1PR5MAPTRXFP1
SCHEMBL3511310 0.90 S1PR1 (0.69) S1PR1S1PR3S1PR5
SCHEMBL3510888 0.90 S1PR1 (0.69) S1PR1S1PR3S1PR5

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US claimed
EP-2149549-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF HEPATITIS Daiichi Sankyo Company, Limited (JP) 2010-02-03 EP claimed
EP-2045325-B1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO CO LTD (JP) 2012-09-19 EP disclosed
EP-1915994-B1 CYCLIC AMINE DERIVATIVES IN COMBINATION WITH PPAR REGULATORS DAIICHI SANKYO CO LTD (JP) 2012-08-01 EP disclosed
US-8101650-B2 Method for treating a immunology-related disease DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-24 US disclosed
US-8067396-B2 Amino alcohol compounds or phosphonic acid derivatives thereof SANKYO COMPANY, LIMITED (JP) 2011-11-29 US disclosed
US-20100248227-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-09-30 US disclosed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100035842-A1 Amino alcohol compounds or phosphonic acid derivatives thereof SANKYO COMPANY, LIMITED (JP) 2010-02-11 US disclosed
EP-2045325-A1 DRUG-PHOSPHORYLATING ENZYME Daiichi Sankyo Company, Limited (JP) 2009-04-08 EP disclosed
US-20080153882-A1 Pharmaceutical Composition Comprising Ppar Regulator DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-06-26 US disclosed
US-20080153882-A1 Pharmaceutical Composition Comprising Ppar Regulator DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-06-26 US disclosed
EP-1915994-A1 CYCLIC AMINE DERIVATIVE CONTAINING PPAR REGULATOR Sankyo Company, Limited (JP) 2008-04-30 EP disclosed
US-20070142335-A1 Amino alcohol compounds or phosphonic acid derivatives thereof SANKYO COMPANY, LIMITED (JP) 2007-06-21 US disclosed
US-20070105933-A1 Amino alcohol compounds SANKYO COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-7199150-B2 Amino alcohol compounds SANKYO COMPANY, LIMITED (JP) 2007-04-03 US disclosed
US-20050043386-A1 Amino alcohol derivatives or phosphonic acid derivatives and pharmaceutical compositions containing these SANKYO COMPANY, LIMITED (JP) 2005-02-24 US disclosed
EP-1471054-A1 AMINO ALCOHOL DERIVATIVE OR PHOSPHONIC ACID DERIVATIVE AND MEDICINAL COMPOSITION CONTAINING THESE Sankyo Company, Limited (JP) 2004-10-27 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 (6 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-20050043386-A1 Amino alcohol derivatives or phosphonic acid derivatives and pharmaceutical compositions containing these PHOSPHO1, CD4, FCGRT S1PR1 257/4885S1PR3 414/4885S1PR5 503/4885
US-20080153882-A1 Pharmaceutical Composition Comprising Ppar Regulator PPARG, PPARA, PPARD S1PR1 282/4885S1PR3 281/4885S1PR5 725/4885
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS SLC10A1, C1S, C1R S1PR1 516/4885S1PR3 376/4885S1PR5 1153/4885
US-20070105933-A1 Amino alcohol compounds ADH1C, C9, SSB S1PR1 465/4885S1PR3 504/4885S1PR5 1007/4885
US-20070142335-A1 Amino alcohol compounds or phosphonic acid derivatives thereof HRH3, C3AR1, HRH4 S1PR1 70/4885S1PR3 89/4885S1PR5 163/4885
US-20100035842-A1 Amino alcohol compounds or phosphonic acid derivatives thereof PHOSPHO1, ADH1C, ADH1A S1PR1 593/4885S1PR3 622/4885S1PR5 980/4885

“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.