SCHEMBL835829

SCHEMBL835829

c1ccc(-c2cc(-c3cnc4cc(-c5ccncc5)cnn34)ccn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FYN P06241 13/20 0.53
CHEK1 O14757 1/20 0.50
GSK3B P49841 1/20 0.50
KDR P35968 1/20 0.50
MKNK1 Q9BUB5 1/20 0.49
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FGFR1 P11362 1/20 0.43
FGFR3 P22607 1/20 0.43
DYRK1A Q13627 1/20 0.42

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
SCHEMBL836870 0.85 FYN (0.49) FYNCHEK1GSK3BNPC1LMNA
SCHEMBL835537 0.84 BRAF (0.48) FYNKDRDYRK1A
SCHEMBL836996 0.84 FYN (0.58) FYNKDRMKNK1FGFR1FGFR3
SCHEMBL836350 0.83 FGFR1 (0.53) FYNNPC1LMNAMAPTRAB9A
SCHEMBL835641 0.83 FYN (0.49) FYNMAPTFGFR1FGFR3DYRK1A
SCHEMBL835515 0.82 FGFR1 (0.40) FYNCHEK1GSK3BNPC1LMNA
SCHEMBL836070 0.80 MKNK1 (0.49) FYNKDRMKNK1NPC1MAPT
SCHEMBL3034003 0.80 KDR (0.80) FYNCHEK1GSK3BKDRFGFR3
SCHEMBL834829 0.79 FGFR1 (0.70) FYNFGFR1FGFR3
SCHEMBL836315 0.79 KDM4E (0.48) FYNKDRNPC1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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 971/4885CHEK1 4214/4885GSK3B 2569/4885

“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.