SCHEMBL12373753

SCHEMBL12373753

CCc1ccc(OC)c(S(=O)(=O)NC(C)c2cnc(Oc3ccc(C)cc3)n2CC)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.42
RXFP1 Q9HBX9 2/20 0.40
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.38
HPGD P15428 1/20 0.38
POLB P06746 2/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL12373568 0.93 POLB (0.44) ALPLALDH1A1SMN1; SMN2TSHRCASP1
SCHEMBL12373587 0.92 SMN1; SMN2 (0.46) ALPLALDH1A1SMN1; SMN2MAPT
SCHEMBL12373638 0.89 LMNA (0.46) ALPLALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL12373560 0.89 SMN1; SMN2 (0.47) ALPLSMN1; SMN2TSHRHTT
SCHEMBL12373704 0.87 CASP1 (0.45) ALPLSMN1; SMN2TSHRCASP1CASP7
SCHEMBL12373735 0.86 MMP7 (0.43) ALPLALDH1A1SMN1; SMN2
SCHEMBL12373493 0.85 S1PR1 (0.41) ALDH1A1NPSR1
SCHEMBL12373489 0.84 LMNA (0.43) ALDH1A1TSHRHTTNPSR1
SCHEMBL12373527 0.83 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TSHRHTTHPGD
SCHEMBL12373648 0.83 S1PR1 (0.40)

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 ALPL 4816/4885RXFP1 46/4885ALDH1A1 2969/4885

“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.