SCHEMBL12373895

SCHEMBL12373895

CCn1c(C(C)NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cnc1Oc1cccc(NC(C)=O)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
HSD17B10 Q99714 1/20 0.43
P2RX3 P56373 1/20 0.41
CCR2 P41597 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.39
ROCK1 Q13464 1/20 0.38
ADAMTS4 O75173 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
P2RX4 Q99571 1/20 0.38
IDO1 P14902 1/20 0.38
RORC P51449 1/20 0.38

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
SCHEMBL2280663 0.89 S1PR1 (0.43) S1PR1S1PR3CCR2LMNAALDH1A1
SCHEMBL12161015 0.88 S1PR1 (0.59) S1PR1S1PR3HSD17B10P2RX3MEN1
SCHEMBL12373819 0.87 S1PR1 (0.49) S1PR1S1PR3CCR2KMT2AALDH1A1
SCHEMBL2279140 0.86 S1PR1 (0.47) S1PR1S1PR3CCR2KMT2A
SCHEMBL12373808 0.84 S1PR1 (0.44) S1PR1S1PR3CCR2ADAMTS4
SCHEMBL2278598 0.84 S1PR1 (0.44) S1PR1S1PR3CCR2LMNAKMT2A
SCHEMBL12373822 0.83 S1PR1 (0.46) S1PR1S1PR3
SCHEMBL12373790 0.83 S1PR1 (0.52) S1PR1S1PR3CCR2KMT2AALDH1A1
SCHEMBL12373817 0.83 CNR1 (0.51) S1PR1S1PR3CCR2KMT2AALDH1A1
SCHEMBL2279361 0.83 S1PR1 (0.51) S1PR1S1PR3CCR2KMT2A

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 2/4885HSD17B10 2218/4885

“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.