SCHEMBL8538004

SCHEMBL8538004

CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)[C@@H](O)CO

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KLK5 Q9Y337 3/20 0.66
ATM Q13315 1/20 0.56
PSEN1 P49768 3/20 0.55
PSEN2 P49810 3/20 0.55
APH1B Q8WW43 3/20 0.55
NCSTN Q92542 3/20 0.55
APH1A Q96BI3 3/20 0.55
PSENEN Q9NZ42 3/20 0.55
APP P05067 1/20 0.54
CTSS P25774 2/20 0.54
CTSL P07711 1/20 0.54
CTSB P07858 1/20 0.54
CTSK P43235 1/20 0.54
REN P00797 2/20 0.53
ACE P12821 1/20 0.52

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
SCHEMBL8539590 1.00 KLK5 (0.66) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL6814907 1.00 KLK5 (0.66) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL6778243 1.00 KLK5 (0.66) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL4972231 1.00 KLK5 (0.66) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL7392856 0.90 KLK5 (0.67) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL10788604 0.90 KLK5 (0.64) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL12751287 0.89 KLK5 (0.66) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL13328536 0.89 KLK5 (0.66) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL14209635 0.89 KLK5 (0.55) KLK5ATMPSEN1PSEN2APH1B
SCHEMBL5861336 0.89 KLK5 (0.61) KLK5ATMPSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0670305-B1 PROCESS FOR PRODUCING 3-AMINO-2-HYDROXY-1-PROPANOL DERIVATIVE KANEKA CORP (JP) 1998-05-20 EP claimed
US-5744630-A Method of producing 3-amino-2-hydroxy-1-propanol derivatives KANEKA CORPORATION (JP) 1998-04-28 US claimed
EP-0670305-A1 PROCESS FOR PRODUCING 3-AMINO-2-HYDROXY-1-PROPANOL DERIVATIVE KANEKA CORPORATION (JP) 1995-09-06 EP claimed
US-9096576-B2 Compounds and methods for treatment of systemic lupus erythematosus THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2015-08-04 US disclosed
US-20140309255-A1 COMPOUNDS AND METHODS FOR TREATMENT OF SYSTEMIC LUPUS ERYTHEMATOSUS THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2014-10-16 US disclosed
EP-0670305-B1 PROCESS FOR PRODUCING 3-AMINO-2-HYDROXY-1-PROPANOL DERIVATIVE KANEKA CORP (JP) 1998-05-20 EP disclosed
US-5744630-A Method of producing 3-amino-2-hydroxy-1-propanol derivatives KANEKA CORPORATION (JP) 1998-04-28 US disclosed
EP-0670305-A1 PROCESS FOR PRODUCING 3-AMINO-2-HYDROXY-1-PROPANOL DERIVATIVE KANEKA CORPORATION (JP) 1995-09-06 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 (1 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-20140309255-A1 COMPOUNDS AND METHODS FOR TREATMENT OF SYSTEMIC LUPUS ERYTHEMATOSUS SSB, DNASE1L3, SNRPD2 KLK5 1881/4885ATM 2798/4885PSEN1 3825/4885

“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.