SCHEMBL12373925

SCHEMBL12373925

CCn1c(C(C)NS(=O)(=O)c2ccc3ccc(Cl)cc3c2)cnc1Oc1cccc(N2CCN(C)CC2)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 0.45
HTR2C P28335 10/20 0.45
HTR6 P50406 8/20 0.45
HTR2A P28223 7/20 0.45
DRD3 P35462 5/20 0.45
HTR1A P08908 4/20 0.45
S1PR1 P21453 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BRD4 O60885 1/20 0.40
GUSB P08236 1/20 0.39
RAD52 P43351 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
SCHEMBL12373920 0.90 HTR2C (0.43) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL2277665 0.89 S1PR1 (0.42) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12373788 0.89 HTR6 (0.46) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12373942 0.89 GUSB (0.44) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12162122 0.88 S1PR1 (0.52) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12373935 0.87 GUSB (0.40) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12162121 0.86 S1PR1 (0.53) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12373927 0.85 BRD4 (0.41) HTR7HTR2CHTR6HTR2ADRD3
SCHEMBL12373827 0.82 S1PR1 (0.42) HTR7S1PR1SMN1; SMN2GUSB
SCHEMBL12373795 0.81 S1PR1 (0.49) HTR7S1PR1SMN1; SMN2BRD4GUSB

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 HTR7 2085/4885HTR2C 1266/4885HTR6 1705/4885

“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.