SCHEMBL12373875

SCHEMBL12373875

CCn1c(C(C)NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cnc1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 13/20 0.47
S1PR3 Q99500 1/20 0.47
NR3C1 P04150 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
SUMO3 P55854 1/20 0.40
SUMO2 P61956 1/20 0.40
SUMO1 P63165 1/20 0.40
CNR1 P21554 1/20 0.39
TACR1 P25103 1/20 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
SCHEMBL12373851 0.90 S1PR1 (0.50) S1PR1S1PR3NR3C1CNR1
SCHEMBL12373819 0.88 S1PR1 (0.49) S1PR1S1PR3NR3C1SMN1; SMN2CNR1
SCHEMBL12373858 0.88 S1PR1 (0.48) S1PR1S1PR3NR3C1CNR1
SCHEMBL12373856 0.88 S1PR1 (0.50) S1PR1S1PR3NR3C1CNR1
SCHEMBL12373910 0.88 S1PR1 (0.57) S1PR1S1PR3CNR1
SCHEMBL12373902 0.85 S1PR1 (0.46) S1PR1S1PR3NR3C1CNR1
SCHEMBL12373861 0.85 S1PR1 (0.48) S1PR1S1PR3SMN1; SMN2CNR1
SCHEMBL12373908 0.85 S1PR1 (0.48) S1PR1S1PR3NR3C1CNR1
SCHEMBL12373822 0.84 S1PR1 (0.46) S1PR1S1PR3NR3C1CNR1
SCHEMBL12373817 0.83 CNR1 (0.51) S1PR1S1PR3SMN1; SMN2CNR1

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-7994204-B2 Binding inhibitor of sphingosine-1-phosphate TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-08-09 US disclosed
US-7994204-B2 Binding inhibitor of sphingosine-1-phosphate TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-08-09 US disclosed
US-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-07-16 US disclosed
US-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-07-16 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-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE S1PR1, S1PR3, S1PR2 S1PR1 1/4885S1PR3 2/4885NR3C1 165/4885

“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.