SCHEMBL14263192

SCHEMBL14263192

C[C@](N)(CO)C(=O)Nc1ccc(OCCc2cccc(-c3ccccc3)c2)cc1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 16/20 0.76
S1PR3 Q99500 16/20 0.76
S1PR4 O95977 7/20 0.62
S1PR5 Q9H228 7/20 0.62
PPARA Q07869 4/20 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
SCHEMBL4984692 0.90 S1PR1 (0.74) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL4984696 0.90 S1PR1 (0.74) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL4983240 0.86 S1PR1 (1.00) S1PR1S1PR3S1PR4S1PR5
SCHEMBL4983228 0.86 S1PR1 (1.00) S1PR1S1PR3S1PR4S1PR5
SCHEMBL14263147 0.85 S1PR1 (0.60) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL4983989 0.85 S1PR1 (0.75) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL4629063 0.85 S1PR1 (0.75) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL27701123 0.85 S1PR1 (0.69) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL14263166 0.84 S1PR1 (0.56) S1PR1S1PR3S1PR4S1PR5PPARA
SCHEMBL14263198 0.84 S1PR1 (0.59) S1PR1S1PR3S1PR4S1PR5PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064662-A1 Methods and compositions for modulating sphingosine -1- phosphate (S1P) receptor activity PRAECIS PHARMACEUTICALS INCORPORATED (US) 2008-03-13 US disclosed
US-20080064662-A1 Methods and compositions for modulating sphingosine -1- phosphate (S1P) receptor activity PRAECIS PHARMACEUTICALS INCORPORATED (US) 2008-03-13 US disclosed
US-7241812-B2 Methods and compositions for modulating sphingosine-1-phosphate (S1P) receptor activity PRAECIS PHARMACEUTICALS, INC. (US) 2007-07-10 US disclosed
US-7241812-B2 Methods and compositions for modulating sphingosine-1-phosphate (S1P) receptor activity PRAECIS PHARMACEUTICALS, INC. (US) 2007-07-10 US 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-20080064662-A1 Methods and compositions for modulating sphingosine -1- phosphate (S1P) receptor activity S1PR1, S1PR2, S1PR3 S1PR1 1/4885S1PR3 3/4885S1PR4 5/4885

“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.