SCHEMBL12373692

SCHEMBL12373692

CCn1c(C(C)NS(=O)(=O)c2cc(C)ccc2F)cnc1Oc1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 9/20 0.40
S1PR3 Q99500 1/20 0.40
KAT6A Q92794 3/20 0.40
SGK1 O00141 2/20 0.34
ALOX5AP P20292 2/20 0.34
CNR1 P21554 1/20 0.34
FEN1 P39748 1/20 0.34
P2RX3 P56373 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
SCHEMBL12373611 0.94 KAT6A (0.40) S1PR1S1PR3KAT6AP2RX3
SCHEMBL12373679 0.94 S1PR1 (0.42) S1PR1S1PR3KAT6A
SCHEMBL12373639 0.92 S1PR1 (0.38) S1PR1S1PR3KAT6AALOX5APCNR1
SCHEMBL12373591 0.90 ALDH1A1 (0.38) S1PR1S1PR3KAT6AALOX5APFEN1
SCHEMBL12373527 0.90 ALDH1A1 (0.43)
SCHEMBL12373609 0.90 S1PR1 (0.38) S1PR1S1PR3ALOX5APCNR1FEN1
SCHEMBL12373623 0.89 S1PR1 (0.44) S1PR1S1PR3KAT6AALOX5APFEN1
SCHEMBL12373660 0.89 S1PR1 (0.42) S1PR1S1PR3
SCHEMBL12373554 0.89 NR3C1 (0.39) S1PR1S1PR3KAT6AALOX5APCNR1
SCHEMBL12373584 0.89 KAT6A (0.40) S1PR1S1PR3KAT6ACNR1

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

“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.