SCHEMBL12373808

SCHEMBL12373808

CCn1c(C(C)NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cnc1Oc1cccc(N(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 11/20 0.44
S1PR3 Q99500 1/20 0.44
ADAMTS4 O75173 1/20 0.41
NPBWR1 P48145 1/20 0.39
MCHR1 Q99705 1/20 0.39
CNR1 P21554 1/20 0.38
CCR2 P41597 2/20 0.38
PGR P06401 1/20 0.36
GCK P35557 1/20 0.35
NR3C1 P04150 1/20 0.35

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
SCHEMBL12373819 0.89 S1PR1 (0.49) S1PR1S1PR3CNR1CCR2PGR
SCHEMBL2279140 0.88 S1PR1 (0.47) S1PR1S1PR3CNR1CCR2PGR
SCHEMBL2278598 0.86 S1PR1 (0.44) S1PR1S1PR3CNR1CCR2PGR
SCHEMBL12160858 0.86 S1PR1 (0.61) S1PR1S1PR3ADAMTS4NPBWR1MCHR1
SCHEMBL2280663 0.86 S1PR1 (0.43) S1PR1S1PR3CNR1CCR2PGR
SCHEMBL12373822 0.85 S1PR1 (0.46) S1PR1S1PR3CNR1PGRNR3C1
SCHEMBL12373817 0.85 CNR1 (0.51) S1PR1S1PR3CNR1CCR2PGR
SCHEMBL2279361 0.85 S1PR1 (0.51) S1PR1S1PR3CNR1CCR2
SCHEMBL12373895 0.84 S1PR1 (0.44) S1PR1S1PR3ADAMTS4CCR2
SCHEMBL12373827 0.84 S1PR1 (0.42) S1PR1S1PR3CNR1CCR2

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 2/4885ADAMTS4 3922/4885

“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.