SCHEMBL3949465

SCHEMBL3949465

COC(=O)c1cccc(Nc2cc(Oc3ccc(C)nc3C)ccn2)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 14/20 0.61
ROCK1 Q13464 1/20 0.54
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TP53 P04637 2/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
SRC P12931 1/20 0.45

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
SCHEMBL3944990 0.91 TGFBR1 (0.62) TGFBR1TP53
SCHEMBL3947619 0.90 TGFBR1 (0.61) TGFBR1TP53
SCHEMBL3947614 0.89 TGFBR1 (0.60) TGFBR1ROCK1
SCHEMBL4187880 0.88 TGFBR1 (0.59) TGFBR1ROCK1
SCHEMBL4171178 0.85 TGFBR1 (0.55) TGFBR1
SCHEMBL3952724 0.85 TGFBR1 (0.55) TGFBR1
SCHEMBL4181719 0.84 TGFBR1 (0.55) TGFBR1ROCK1
SCHEMBL4040119 0.84 TGFBR1 (0.67) TGFBR1
SCHEMBL3944569 0.83 TGFBR1 (0.54) TGFBR1SRC
SCHEMBL3946128 0.81 TGFBR1 (0.63) TGFBR1

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-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 TGFBR1 1/4885ROCK1 463/4885MAPT 3204/4885

“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.