SCHEMBL1493472

SCHEMBL1493472

O=C(O)CSc1nnnn1-c1ccccc1F

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.68
KMT2A Q03164 5/20 0.65
MEN1 O00255 4/20 0.65
MAPK1 P28482 2/20 0.65
ALDH1A1 P00352 9/20 0.60
MAPT P10636 2/20 0.59
LMNA P02545 2/20 0.56
USP2 O75604 1/20 0.56
TSHR P16473 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
CPB1 P15086 1/20 0.52
HSD17B10 Q99714 1/20 0.51
HPGD P15428 1/20 0.51

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
SCHEMBL1493487 0.84 ALDH1A1 (0.79) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL1493435 0.84 ALDH1A1 (0.79) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL6279510 0.83 KMT2A (0.73) POLBKMT2AMEN1ALDH1A1MAPT
SCHEMBL859415 0.82 ALDH1A1 (0.74) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL1610031 0.81 POLB (1.00) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL1493362 0.81 MAPK1 (0.78) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL7992707 0.80 POLB (0.97) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL6273823 0.79 KMT2A (1.00) POLBKMT2AMEN1ALDH1A1MAPT
SCHEMBL1493401 0.79 ALDH1A1 (0.64) POLBKMT2AMEN1MAPK1ALDH1A1
SCHEMBL23009199 0.78 ALDH1A1 (0.63) KMT2AMEN1MAPK1ALDH1A1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086889-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-04-14 US disclosed
EP-2288603-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2011-03-02 EP disclosed
WO-2009150614-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2009-12-17 WO 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-20110086889-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY1R POLB 4782/4885KMT2A 1510/4885MEN1 683/4885

“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.