SCHEMBL12373584

SCHEMBL12373584

CCn1c(C(C)NS(=O)(=O)c2ccc(F)cc2F)cnc1Oc1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.40
S1PR1 P21453 3/20 0.37
S1PR3 Q99500 1/20 0.37
PIK3CA P42336 5/20 0.37
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
PIK3R1 P27986 2/20 0.36
AXL P30530 1/20 0.35
SLC22A12 Q96S37 2/20 0.35
PI4KA P42356 1/20 0.35
PIK3CG P48736 1/20 0.35
CNR1 P21554 1/20 0.35
KCNH2 Q12809 1/20 0.34
HTT P42858 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34

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
SCHEMBL12373677 0.93 NR3C1 (0.36) S1PR1S1PR3TP53MAPTSLC22A12
SCHEMBL12373611 0.93 KAT6A (0.40) KAT6AS1PR1S1PR3TP53MAPT
SCHEMBL12373589 0.91 S1PR1 (0.40) S1PR1S1PR3PIK3CATP53MAPT
SCHEMBL12373668 0.91 KMT2A (0.36) S1PR1S1PR3TP53MAPTSLC22A12
SCHEMBL12373621 0.91 NMT1 (0.39) KAT6AS1PR1S1PR3MAPTCNR1
SCHEMBL12373660 0.91 S1PR1 (0.42) S1PR1S1PR3
SCHEMBL12373565 0.91 TRIM24 (0.40) S1PR1S1PR3TP53MAPTHTT
SCHEMBL12373639 0.91 S1PR1 (0.38) KAT6AS1PR1S1PR3CNR1
SCHEMBL12373694 0.89 S1PR1 (0.39) S1PR1S1PR3TP53MAPT
SCHEMBL12373554 0.89 NR3C1 (0.39) KAT6AS1PR1S1PR3CNR1

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 KAT6A 4593/4885S1PR1 1/4885S1PR3 2/4885

“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.