SCHEMBL835778

SCHEMBL835778

Oc1cccc(-c2cnn3c(-c4cccc(-n5cccn5)c4)cnc3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FYN P06241 16/20 0.47
ERCC1 P07992 1/20 0.45
ERCC4 Q92889 1/20 0.45
MKNK1 Q9BUB5 1/20 0.44
TBK1 Q9UHD2 2/20 0.42
FGFR1 P11362 1/20 0.41
FGFR3 P22607 1/20 0.41
IKBKE Q14164 1/20 0.41

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
SCHEMBL837388 0.87 GRM5 (0.45) FYNERCC1ERCC4TBK1FGFR1
SCHEMBL837456 0.85 GABRG2 (0.44) FYNERCC1ERCC4MKNK1TBK1
SCHEMBL835796 0.82 FYN (0.54) FYN
SCHEMBL836898 0.82 FGFR3 (0.67) FYNERCC1ERCC4TBK1FGFR1
SCHEMBL836098 0.80 FGFR3 (0.39) ERCC1ERCC4MKNK1TBK1FGFR1
SCHEMBL836396 0.78 FGFR1 (0.43) TBK1FGFR1FGFR3
SCHEMBL834911 0.77 FYN (0.49) FYNMKNK1TBK1FGFR1FGFR3
SCHEMBL836435 0.76 CNR2 (0.47) FGFR1FGFR3
SCHEMBL2343152 0.76 FYN (0.42) FYNTBK1FGFR1FGFR3IKBKE
SCHEMBL836215 0.74 KDR (0.59) ERCC1ERCC4FGFR1FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101765442-B Organic compounds NOVARTIS AG 2014-09-17 CN claimed
US-8143253-B2 Organic compounds NOVARTIS AG (CH) 2012-03-27 US claimed
EP-2183027-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-08-31 EP claimed
US-20100204235-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-08-12 US claimed
CN-101765442-A organic compounds NOVARTIS AG 2010-06-30 CN claimed
EP-2183027-A1 ORGANIC COMPOUNDS Novartis Ag (CH) 2010-05-12 EP claimed
WO-2009013335-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-01-29 WO claimed
CN-101765442-B Organic compounds NOVARTIS AG 2014-09-17 CN disclosed
US-8143253-B2 Organic compounds NOVARTIS AG (CH) 2012-03-27 US disclosed
EP-2183027-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-08-31 EP disclosed
US-20100204235-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-08-12 US disclosed
CN-101765442-A organic compounds NOVARTIS AG 2010-06-30 CN disclosed
EP-2183027-A1 ORGANIC COMPOUNDS Novartis Ag (CH) 2010-05-12 EP disclosed
WO-2009013335-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-01-29 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-20100204235-A1 ORGANIC COMPOUNDS ALK, OR10J3, FFAR4 FYN 971/4885ERCC1 4752/4885ERCC4 4861/4885

“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.