SCHEMBL5871382

SCHEMBL5871382

COc1cc(OCC[S+](C)c2c([O-])c3cccnc3n(C)c2=O)cc(OC)c1OC

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SYK P43405 4/20 0.35
MMP10 P09238 1/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
NPBWR1 P48145 1/20 0.34
FEN1 P39748 1/20 0.34
THRB P10828 1/20 0.34
PTAFR P25105 1/20 0.33
BRD4 O60885 1/20 0.33
KDR P35968 1/20 0.32
FLT3 P36888 1/20 0.32

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
SCHEMBL5871627 0.87 MAPT (0.40) LIPGL3MBTL1KMT2ATHRBPTAFR
SCHEMBL5871823 0.82 MAPT (0.42) L3MBTL1MEN1KMT2ANPBWR1THRB
SCHEMBL5871987 0.82 MAPT (0.48) L3MBTL1THRB
SCHEMBL5872271 0.74 MAPT (0.41) L3MBTL1MEN1KMT2ANPBWR1THRB
SCHEMBL7954712 0.63 PDE4A (0.48) L3MBTL1MEN1KMT2ATHRB
SCHEMBL5871439 0.62 LIPG (0.43) LIPGL3MBTL1MEN1KMT2ATHRB
SCHEMBL7955057 0.61 PDE4A (0.51) MEN1KMT2ATHRB
SCHEMBL7954380 0.60 RXFP1 (0.52) SMN1; SMN2HSD17B10MEN1KMT2ATHRB
SCHEMBL9709087 0.60 KMT2A (0.50) LIPGL3MBTL1KMT2ATHRB
SCHEMBL28966880 0.59 ADORA2A (0.43) HPGDNPBWR1FEN1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071187-B2 Naphthyridine derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2006-07-04 US claimed
US-20040214853-A1 Naphthyridine derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2004-10-28 US claimed
US-7071187-B2 Naphthyridine derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2006-07-04 US disclosed
US-20040214853-A1 Naphthyridine derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2004-10-28 US disclosed
EP-1426374-A1 NAPHTHYRIDINE DERIVATIVE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2004-06-09 EP 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-20040214853-A1 Naphthyridine derivatives MT-ND1, OPRD1, NR0B1 LIPG 3691/4885L3MBTL1 1727/4885SMN1; SMN2 161/4885

“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.