SCHEMBL834014

SCHEMBL834014

Brc1cnc2cc(-c3ccncc3)cnn12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.41
KDR P35968 2/20 0.40
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
PDGFRB P09619 5/20 0.37
PDGFRA P16234 5/20 0.37
HTT P42858 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FYN P06241 4/20 0.36
EGFR P00533 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35

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
SCHEMBL836424 0.83 CYP2A6 (0.46) MKNK1KDRPDGFRBPDGFRAALDH1A1
SCHEMBL1691904 0.82 FLT3 (0.41) MKNK1LMNAMAPTPDGFRBPDGFRA
SCHEMBL3026835 0.73 KDR (0.61) KDRLMNAMAPTPIK3CAFLT3
SCHEMBL836070 0.73 MKNK1 (0.49) MKNK1KDRMAPTHTTFYN
SCHEMBL835829 0.70 FYN (0.53) MKNK1KDRLMNAMAPTFYN
SCHEMBL21644070 0.70 FYN (0.61) FYNDYRK1A
SCHEMBL18397067 0.69 KCNJ5 (0.31) HPGD
SCHEMBL837859 0.69 DYRK1A (0.49) MKNK1KDRLMNAMAPTPDGFRB
SCHEMBL837839 0.68 FGFR1 (0.65) PDGFRBFYNPIK3CGFLT3
SCHEMBL837219 0.68 FYN (0.48) KDM4EALDH1A1CYP1A2HPGDFYN

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-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
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 MKNK1 3948/4885KDR 60/4885LMNA 2812/4885

“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.