SCHEMBL836455

SCHEMBL836455

Fc1cccc(-c2cnn3c(Br)cnc3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.44
GRIN1 Q05586 4/20 0.41
GRIN2B Q13224 4/20 0.41
FLT3 P36888 2/20 0.41
FYN P06241 5/20 0.40
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
CYP11B2 P19099 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ESR2 Q92731 1/20 0.37
CHEK2 O96017 1/20 0.36
CYP11B1 P15538 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL1691904 0.83 FLT3 (0.41) EGLN2GRIN1GRIN2BFLT3FYN
SCHEMBL834862 0.79 EGLN2 (0.48) EGLN2GRIN1GRIN2BFYNPDGFRB
SCHEMBL836424 0.78 CYP2A6 (0.46) FYNPDGFRBPDGFRACYP11B2CYP11B1
SCHEMBL834014 0.75 MKNK1 (0.41) FLT3FYNPDGFRBPDGFRA
SCHEMBL836775 0.74 FYN (0.54) FYN
SCHEMBL837219 0.74 FYN (0.48) FYN
SCHEMBL837839 0.74 FGFR1 (0.65) FLT3FYNPDGFRB
SCHEMBL1829850 0.73 KCNH2 (0.42) EGLN2FLT3FYNTAAR1ESR2
SCHEMBL836870 0.73 FYN (0.49) EGLN2GRIN1GRIN2BFLT3FYN
SCHEMBL836997 0.72 FYN (0.60) FYNCHEK2

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 EGLN2 3299/4885GRIN1 1448/4885GRIN2B 1588/4885

“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.