SCHEMBL12373690

SCHEMBL12373690

CCn1c(C(C)NS(=O)(=O)c2ccc(C)c(C)c2)cnc1Oc1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 9/20 0.41
S1PR3 Q99500 1/20 0.41
CNR1 P21554 1/20 0.38
TRIM24 O15164 1/20 0.37
BRD1 O95696 1/20 0.37
BRPF1 P55201 1/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
GCK P35557 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
SCHEMBL12373517 0.92 S1PR1 (0.44) S1PR1S1PR3CNR1CA12CA2
SCHEMBL12373665 0.92 S1PR1 (0.39) S1PR1S1PR3CNR1PKMCA12
SCHEMBL12373675 0.92 S1PR1 (0.45) S1PR1S1PR3CNR1TRIM24BRD1
SCHEMBL12373481 0.92 S1PR1 (0.47) S1PR1S1PR3CNR1
SCHEMBL12373509 0.89 S1PR1 (0.41) S1PR1S1PR3CNR1CA12CA2
SCHEMBL4119410 0.89 CNR1 (0.47) S1PR1S1PR3CNR1TRIM24BRPF1
SCHEMBL12373648 0.89 S1PR1 (0.40) S1PR1S1PR3CNR1PKMCA12
SCHEMBL12373566 0.89 S1PR1 (0.40) S1PR1S1PR3CNR1PKMCA12
SCHEMBL12373503 0.89 CYSLTR1 (0.43) S1PR1S1PR3
SCHEMBL2278141 0.89 S1PR1 (0.48) S1PR1S1PR3CNR1

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 2/4885CNR1 17/4885

“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.