SCHEMBL4149607

SCHEMBL4149607

CC(C)(C)OC(=O)n1cncc1CO

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.37
MARK3 P27448 1/20 0.37
MAP4K2 Q12851 1/20 0.37
CAMK2B Q13554 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
BCHE P06276 1/20 0.36
GPR119 Q8TDV5 7/20 0.35
FAAH O00519 1/20 0.35
IDO1 P14902 4/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BUB1 O43683 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
NR1H2 P55055 1/20 0.33
CYP11B2 P19099 1/20 0.32

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
SCHEMBL8312657 0.88 GPR119 (0.36) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL16060936 0.86 PIM1 (0.36) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL20864185 0.86 FAAH (0.43) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL6555080 0.84 PIM1 (0.35) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL2789678 0.82 NR1H2 (0.38) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL15874826 0.79 TBXAS1 (0.46) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL7654635 0.78 PIM1 (0.39) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL406298 0.78 ATM (0.38)
SCHEMBL9516130 0.77 PIM1 (0.38) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL6950813 0.77 BCHE (0.32) PIM1MARK3MAP4K2CAMK2BPIM3

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9550757-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2017-01-24 US disclosed
US-9550757-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2017-01-24 US disclosed
EP-2542089-B1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2017-01-18 EP disclosed
US-20140155370-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics Inc. 2014-06-05 US disclosed
US-20140155370-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics Inc. 2014-06-05 US disclosed
US-8513230-B2 Nuclear transport modulators and uses thereof KARYOPHARM THERAPEUTICS, INC. (US) 2013-08-20 US disclosed
US-8513230-B2 Nuclear transport modulators and uses thereof KARYOPHARM THERAPEUTICS, INC. (US) 2013-08-20 US disclosed
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2011-11-10 US disclosed
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2011-11-10 US disclosed
WO-2011109799-A1 NUCLEAR TRANSPORT MODULATIORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2011-09-09 WO disclosed
EP-1888512-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-20 EP disclosed
WO-2006133216-A2 4-SUBSTITUTED ARYLAMINE DERIVATIVES AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-14 WO disclosed
EP-0903347-B1 NOVEL CYCLIC DEPSIPEPTIDE PF1022 DERIVATIVES MEIJI SEIKA KAISHA (JP) 2005-07-20 EP disclosed
CN-1082051-C Novel cyclic depsipeptide PF1022 derivatives MEIJI SEIKA CO (JP) 2002-04-03 CN disclosed
US-6329338-B1 CYCLIC OLIGOPEPTIDE TETRAESTES MEIJI SEIKA KAISHA, LTD. (JP) 2001-12-11 US disclosed
EP-0903347-A1 NOVEL CYCLIC DEPSIPEPTIDE PF1022 DERIVATIVES MEIJI SEIKA KAISHA LTD. (JP) 1999-03-24 EP disclosed
CN-1201456-A Novel cyclic depsipeptide PF1022 derivatives MEIJI SEIKA CO (JP) 1998-12-09 CN disclosed
US-5173496-A Antiinflammatory agents ICI PHARMA (FR) 1992-12-22 US disclosed
EP-0284174-B1 THERAPEUTIC PREPARATIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-29 EP disclosed
EP-0284174-A1 Therapeutic preparations IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-09-28 EP 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 (2 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-20140155370-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, NXF1, XPOT PIM1 3173/4885MARK3 1362/4885MAP4K2 897/4885
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, NXF1, XPOT PIM1 3173/4885MARK3 1362/4885MAP4K2 897/4885

“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.