SCHEMBL274874

SCHEMBL274874

COC(=O)c1cccc2cc(Oc3ccnc(C)c3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.54
FGFR1 P11362 1/20 0.53
KDR P35968 18/20 0.51
AURKA O14965 11/20 0.50
TEK Q02763 11/20 0.50
MET P08581 10/20 0.50
AURKB Q96GD4 7/20 0.50
LCK P06239 7/20 0.50
ABL1 P00519 2/20 0.49
LYN P07948 2/20 0.49
CYP3A4 P08684 2/20 0.47
FGR P09769 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL2706583 0.88 KDR (0.50) FGFR1KDRAURKATEKMET
SCHEMBL22048761 0.87 KDR (0.55) PDE4BFGFR1KDRAURKATEK
SCHEMBL22540530 0.87 KDR (0.62) FGFR1KDRAURKATEKMET
SCHEMBL273636 0.83 KDR (0.53) PDE4BFGFR1KDRAURKATEK
SCHEMBL2747219 0.80 PDE4B (0.53) PDE4BFGFR1KDRAURKATEK
SCHEMBL2237855 0.79 MTNR1A (0.56) PDE4BKDRAURKATEKMET
SCHEMBL272701 0.78 KDR (0.50) PDE4BKDRAURKATEKMET
SCHEMBL272848 0.78 KDR (0.50) PDE4BKDRAURKATEKMET
SCHEMBL2435692 0.77 KDR (0.71) KDRAURKAAURKBLCKABL1
SCHEMBL273502 0.76 PDE4B (0.50) PDE4BKDRAURKATEKMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133886-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2012-03-13 US disclosed
US-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers NOVARTIS AG (CH) 2010-02-04 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-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers SLC8B1, MCU, GLS PDE4B 2295/4885FGFR1 1214/4885KDR 3083/4885

“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.