SCHEMBL14847348

SCHEMBL14847348

O=C1NCc2cc(-c3cccc(B(O)O)c3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 3/20 0.51
GSK3B P49841 2/20 0.51
DAPK3 O43293 1/20 0.51
NTRK1 P04629 1/20 0.51
PIM1 P11309 1/20 0.51
FLT3 P36888 1/20 0.51
ROCK1 Q13464 1/20 0.51
PARP10 Q53GL7 6/20 0.50
PARP11 Q9NR21 6/20 0.50
PRF1 P14222 3/20 0.50
DYRK1B Q9Y463 2/20 0.50
TYRO3 Q06418 1/20 0.50
NTRK2 Q16620 1/20 0.50
TARS1 P26639 1/20 0.49
FYN P06241 1/20 0.49
MGLL Q99685 1/20 0.47
GRM5 P41594 2/20 0.46
TDP2 O95551 1/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL29956179 0.83 CA12 (0.48) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL20599741 0.83 CA12 (0.48) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL14847350 0.82 GSK3B (0.54) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL15962138 0.82 CLK4 (0.54) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL10243599 0.81 PARP10 (0.74) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL8167297 0.80 CLK4 (0.75) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL15962134 0.80 CLK4 (0.54) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL14847333 0.80 GSK3B (0.58) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL14847341 0.79 PARP10 (0.50) CLK4GSK3BDAPK3NTRK1PIM1
SCHEMBL13680532 0.78 CLK4 (0.78) CLK4GSK3BDAPK3NTRK1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9630979-B2 Inhibitors of monoacylglycerol lipase and methods of their use INFINITY PHARMACEUTICALS, INC. (US) 2017-04-25 US disclosed
US-20140235580-A1 INHIBITORS OF MONOACYLGLYCEROL LIPASE AND METHODS OF THEIR USE INFINITY PHARMACEUTICALS, INC. 2014-08-21 US disclosed
WO-2013049332-A1 INHIBITORS OF MONOACYLGLYCEROL LIPASE AND METHODS OF THEIR USE INFINITY PHARMACEUTICALS, INC. (US) 2013-04-04 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-20140235580-A1 INHIBITORS OF MONOACYLGLYCEROL LIPASE AND METHODS OF THEIR USE MGLL, PNLIP, LIPC CLK4 2289/4885GSK3B 1577/4885DAPK3 2852/4885

“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.