SCHEMBL12373463

SCHEMBL12373463

CCn1c(C(C)NS(=O)(=O)c2ccccc2)cnc1Oc1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.41
S1PR1 P21453 9/20 0.41
FFAR1 O14842 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MMP9 P14780 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LOXL2 Q9Y4K0 3/20 0.39
AOC3 Q16853 2/20 0.39
CNR1 P21554 2/20 0.39

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
SCHEMBL12373577 0.96 FFAR1 (0.47) MMP13S1PR1FFAR1ALDH1A1MMP9
SCHEMBL12373517 0.96 S1PR1 (0.44) MMP13S1PR1FFAR1ALDH1A1CNR1
SCHEMBL12373539 0.94 ADAMTS4 (0.43) MMP13S1PR1FFAR1ALDH1A1MMP9
SCHEMBL4119410 0.93 CNR1 (0.47) MMP13S1PR1ALDH1A1MMP9CNR1
SCHEMBL12373523 0.92 KMT2A (0.40) MMP13S1PR1ALDH1A1SMN1; SMN2CNR1
SCHEMBL12373499 0.92 S1PR1 (0.41) MMP13S1PR1CNR1
SCHEMBL12373769 0.91 S1PR1 (0.45) S1PR1ALDH1A1
SCHEMBL12373473 0.91 S1PR1 (0.53) S1PR1ALDH1A1
SCHEMBL12373493 0.91 S1PR1 (0.41) MMP13S1PR1ALDH1A1CNR1
SCHEMBL12373495 0.91 S1PR1 (0.43) S1PR1SMN1; 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 MMP13 3607/4885S1PR1 1/4885FFAR1 52/4885

“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.