SCHEMBL12373749

SCHEMBL12373749

CCOc1ccc(S(=O)(=O)NC(C)c2cnc(Oc3ccc(C)cc3)n2CC)cc1NC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
MGAT2 Q10469 1/20 0.41
S1PR1 P21453 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
IDH2 P48735 1/20 0.36
EPHX1 P07099 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL12373635 0.88 S1PR1 (0.43) ALDH1A1MAPTS1PR1KMT2AL3MBTL1
SCHEMBL12373741 0.87 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL12373461 0.86 MAPT (0.50) ALDH1A1MAPTKMT2AMEN1L3MBTL1
SCHEMBL12373746 0.85 TDP1 (0.41) ALDH1A1MAPTKMT2AMEN1L3MBTL1
SCHEMBL12373489 0.84 LMNA (0.43) ALDH1A1S1PR1KMT2AMEN1
SCHEMBL12373517 0.83 S1PR1 (0.44) ALDH1A1S1PR1KMT2ACYP2C19
SCHEMBL12373462 0.82 ADAMTS4 (0.43) ALDH1A1MAPTS1PR1KMT2AMEN1
SCHEMBL12373690 0.82 S1PR1 (0.41) S1PR1
SCHEMBL12373743 0.81 SMN1; SMN2 (0.41) ALDH1A1S1PR1KMT2ARAB9A
SCHEMBL4119410 0.81 CNR1 (0.47) ALDH1A1S1PR1L3MBTL1

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 ALDH1A1 2969/4885MAPT 3475/4885MGAT2 3216/4885

“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.