SCHEMBL4583183

SCHEMBL4583183

CC(C)(C)N(C(=O)O)c1cc(B2OC(C)(C)C(C)(C)O2)cs1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F11 P03951 3/20 0.34
F2 P00734 2/20 0.34
PRSS1 P07477 2/20 0.34
PRSS2 P07478 2/20 0.34
PRSS3 P35030 2/20 0.34
LIPG Q9Y5X9 4/20 0.33
P4HB P07237 1/20 0.33
LPL P06858 3/20 0.33
HIF1A Q16665 1/20 0.32
FFAR1 O14842 1/20 0.32
DGAT1 O75907 1/20 0.32
USP30 Q70CQ3 1/20 0.31

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
SCHEMBL2136697 0.74 LIPG (0.46) F11F2PRSS1PRSS2PRSS3
SCHEMBL4753530 0.73 LIPG (0.40) F11F2PRSS1PRSS2PRSS3
SCHEMBL1400888 0.72 LIPG (0.36) F11F2PRSS1PRSS2PRSS3
SCHEMBL1130443 0.72 DAO (0.46) F11F2PRSS1PRSS2PRSS3
SCHEMBL1558987 0.72 PDGFRB (0.37) F11F2PRSS1PRSS2PRSS3
SCHEMBL59027 0.72 F11 (0.39) F11F2PRSS1PRSS2PRSS3
SCHEMBL5263215 0.71 CES2 (0.38)
SCHEMBL59978 0.71 ROCK1 (0.42) F11F2PRSS1PRSS2PRSS3
SCHEMBL58297 0.71 AAK1 (0.44) F11F2PRSS1PRSS2PRSS3
SCHEMBL1554719 0.71 DGAT1 (0.37) F11F2PRSS1PRSS2PRSS3

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-9145414-B2 1,2,4-triazine-6-carboxamide derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-09-29 US disclosed
US-20140343038-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2014-11-20 US disclosed
EP-2762476-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE Taiho Pharmaceutical Co., Ltd. (JP) 2014-08-06 EP disclosed
EP-1968568-A2 INHIBITORS OF Akt ACTIVITY SmithKline Beecham Corporation (US) 2008-09-17 EP disclosed
WO-2007076423-A2 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2007-07-05 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-20140343038-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE SYK, BTK, JAK2 F11 905/4885F2 1582/4885PRSS1 2582/4885

“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.