SCHEMBL12373579

SCHEMBL12373579

CCn1c(C(C)NS(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)cnc1Oc1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 13/20 0.40
S1PR3 Q99500 1/20 0.40
NR3C1 P04150 5/20 0.37
PGR P06401 1/20 0.35
NR3C2 P08235 1/20 0.35
NPBWR1 P48145 1/20 0.34
MCHR1 Q99705 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL12373637 0.95 NR3C1 (0.41) S1PR1S1PR3NR3C1PGRNR3C2
SCHEMBL12373686 0.93 S1PR1 (0.37) S1PR1S1PR3NPBWR1MCHR1KMT2A
SCHEMBL12373488 0.91 S1PR1 (0.39) S1PR1S1PR3NR3C1PGRNR3C2
SCHEMBL12373615 0.90 ALDH1A1 (0.44) S1PR1S1PR3NPBWR1MCHR1KMT2A
SCHEMBL12373549 0.89 S1PR1 (0.44) S1PR1S1PR3PGRKMT2ACYP2D6
SCHEMBL12373581 0.89 S1PR1 (0.41) S1PR1S1PR3NR3C1NR3C2
SCHEMBL12373563 0.87 S1PR1 (0.35) S1PR1S1PR3
SCHEMBL12373486 0.87 S1PR1 (0.41) S1PR1S1PR3NR3C1KMT2A
SCHEMBL12373545 0.87 NR3C1 (0.39) S1PR1S1PR3NR3C1NPBWR1MCHR1
SCHEMBL12373514 0.86 PGR (0.39) S1PR1S1PR3NR3C1PGRNR3C2

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.