SCHEMBL12373735

SCHEMBL12373735

CCn1c(C(C)NS(=O)(=O)c2ccc(OC)cc2OC)cnc1Oc1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP7 P09237 1/20 0.43
CNR1 P21554 1/20 0.41
ALPL P05186 2/20 0.39
S1PR1 P21453 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
CYP19A1 P11511 1/20 0.37
RAPGEF3 O95398 1/20 0.37
MAPK1 P28482 1/20 0.37
GFER P55789 1/20 0.37
TP53 P04637 1/20 0.36

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
SCHEMBL12373587 0.93 SMN1; SMN2 (0.46) CNR1ALPLALDH1A1SMN1; SMN2
SCHEMBL12373568 0.90 POLB (0.44) ALPLGAAALDH1A1SMN1; SMN2
SCHEMBL12373704 0.90 CASP1 (0.45) ALPLSMN1; SMN2
SCHEMBL12373527 0.87 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL12373638 0.86 LMNA (0.46) ALPLS1PR1ALDH1A1SMN1; SMN2
SCHEMBL12373753 0.86 ALPL (0.42) ALPLALDH1A1SMN1; SMN2
SCHEMBL12373560 0.86 SMN1; SMN2 (0.47) ALPLGAAPKMSMN1; SMN2
SCHEMBL4119410 0.85 CNR1 (0.47) MMP7CNR1S1PR1ALDH1A1
SCHEMBL12373552 0.85 PGR (0.44) CNR1ALPLS1PR1GAAALDH1A1
SCHEMBL12373489 0.85 LMNA (0.43) CNR1S1PR1ALDH1A1MAPK1TP53

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 MMP7 3408/4885CNR1 17/4885ALPL 4816/4885

“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.