SCHEMBL12373700

SCHEMBL12373700

CCn1c(C(C)NS(=O)(=O)c2ccccc2-c2ccc(OC)cc2)cnc1Oc1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 8/20 0.39
ALOX5AP P20292 7/20 0.39
MCHR1 Q99705 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
EDNRA P25101 1/20 0.38
CASP1 P29466 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRK1 P41145 1/20 0.37

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
SCHEMBL12373704 0.89 CASP1 (0.45) CASP1
SCHEMBL12373520 0.89 CASP1 (0.39) MEN1KMT2ACASP1
SCHEMBL12373501 0.88 CYP1A2 (0.41) MEN1KMT2ACASP1
SCHEMBL12373547 0.87 PGR (0.40) MCHR1MEN1KMT2ACASP1
SCHEMBL12373466 0.87 POLB (0.40) MEN1KMT2ACASP1
SCHEMBL12373591 0.87 ALDH1A1 (0.38) FEN1ALOX5APMEN1KMT2ACASP1
SCHEMBL4119410 0.86 CNR1 (0.47)
SCHEMBL12373539 0.86 ADAMTS4 (0.43)
SCHEMBL12373463 0.85 MMP13 (0.41)
SCHEMBL12373511 0.85 PGR (0.42) EDNRACASP1

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 FEN1 1620/4885ALOX5AP 1351/4885MCHR1 130/4885

“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.