SCHEMBL12373549

SCHEMBL12373549

CCn1c(C(C)NS(=O)(=O)c2cc(Cl)cc(Cl)c2)cnc1Oc1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 18/20 0.44
S1PR3 Q99500 1/20 0.43
KMT2A Q03164 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
PGR P06401 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
SCHEMBL12373593 0.92 S1PR1 (0.46) S1PR1S1PR3KMT2APGR
SCHEMBL12373473 0.91 S1PR1 (0.53) S1PR1S1PR3KMT2ACYP2D6CYP2C19
SCHEMBL12373648 0.91 S1PR1 (0.40) S1PR1S1PR3
SCHEMBL12373517 0.90 S1PR1 (0.44) S1PR1S1PR3KMT2ACYP2D6CYP2C19
SCHEMBL12373579 0.89 S1PR1 (0.40) S1PR1S1PR3KMT2ACYP2D6CYP2C19
SCHEMBL2278141 0.89 S1PR1 (0.48) S1PR1S1PR3KMT2ACYP2D6CYP2C19
SCHEMBL12373658 0.88 S1PR1 (0.41) S1PR1S1PR3
SCHEMBL12373550 0.88 S1PR1 (0.59) S1PR1S1PR3KMT2ACYP2D6CYP2C19
SCHEMBL12373463 0.88 MMP13 (0.41) S1PR1
SCHEMBL12373481 0.88 S1PR1 (0.47) S1PR1S1PR3KMT2ACYP2D6CYP2C19

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 2/4885KMT2A 3906/4885

“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.