SCHEMBL5140340

SCHEMBL5140340

CCNOC(=O)c1cc(-c2cnc3c(c2)c(-c2ccccc2OC)cn3S(=O)(=O)c2ccc(C)cc2)cnc1NCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.42
MAPT P10636 4/20 0.38
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HTT P42858 1/20 0.36
PDPK1 O15530 1/20 0.36
TRIM24 O15164 2/20 0.34
TRIM33 Q9UPN9 2/20 0.34
EED O75530 2/20 0.34
MAP4K1 Q92918 1/20 0.34
HSD17B10 Q99714 2/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
ALOX5 P09917 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL1516627 0.81 PTPN11 (0.47) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL1516771 0.79 PTPN11 (0.46) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL1516677 0.79 PTPN11 (0.43) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL1516691 0.79 PTPN11 (0.47) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL3563733 0.79 PTPN11 (0.43) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL1516618 0.79 PTPN11 (0.48) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL13342637 0.78 PTPN11 (0.51) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL14208401 0.78 PTPN11 (0.42) PTPN11MAPTTSHRSMN1; SMN2KMT2A
SCHEMBL3568123 0.77 PTPN11 (0.48) PTPN11MAPTTSHRSMN1; SMN2MAP4K1
SCHEMBL1516754 0.77 PTPN11 (0.43) PTPN11MAPTTSHRSMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361764-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2008-04-22 US disclosed
US-20070043068-A1 to treat diseases mediated by kinase activity; for example: [3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridine-5-yl]-methyl-phenyl-amine SGX PHARMACEUTICALS, INC. (US) 2007-02-22 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-20070043068-A1 to treat diseases mediated by kinase activity; for example: [3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridine-5-yl]-methyl-phenyl-amine MAP3K20, MAP4K2, MAP3K6 PTPN11 697/4885MAPT 1659/4885TSHR 1281/4885

“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.