SCHEMBL2397448

SCHEMBL2397448

CC(C)(C)OC(=O)N1CCN(c2ccnc3ccc(/C=C4\SC(=O)NC4=O)cc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.53
DYRK1A Q13627 4/20 0.50
PIM1 P11309 4/20 0.50
CLK2 P49760 3/20 0.50
PIK3CD O00329 2/20 0.50
CSNK2A2 P19784 2/20 0.50
PIK3CA P42336 2/20 0.50
PIK3CB P42338 2/20 0.50
MTOR P42345 2/20 0.50
PIK3CG P48736 2/20 0.50
CLK1 P49759 2/20 0.50
CSNK1D P48730 2/20 0.50
CSNK1G2 P78368 2/20 0.50
CSNK1G3 Q9Y6M4 2/20 0.50
GAK O14976 1/20 0.50
RPS6KA4 O75676 1/20 0.50
STK10 O94804 1/20 0.50
MAP2K2 P36507 1/20 0.50
MAP2K1 Q02750 1/20 0.50
AAK1 Q2M2I8 1/20 0.50

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
SCHEMBL2397446 1.00 GPR119 (0.53) GPR119DYRK1APIM1CLK2PIK3CD
SCHEMBL2397451 1.00 GPR119 (0.53) GPR119DYRK1APIM1CLK2PIK3CD
SCHEMBL1300086 0.85 PIK3CG (0.53) DYRK1APIM1CLK2PIK3CDCSNK2A2
SCHEMBL1300089 0.85 PIK3CG (0.53) DYRK1APIM1CLK2PIK3CDCSNK2A2
SCHEMBL1300088 0.85 PIK3CG (0.53) DYRK1APIM1CLK2PIK3CDCSNK2A2
SCHEMBL1299882 0.83 IDE (0.47) GPR119CLK1IDEMEN1KMT2A
SCHEMBL12107156 0.83 PIM1 (0.52) DYRK1APIM1CLK2PIK3CDCSNK2A2
SCHEMBL12264963 0.81 IDE (0.39) GPR119DYRK1ACLK2PIK3CACLK1
SCHEMBL1497536 0.80 DYRK1A (0.47) GPR119DYRK1APIM1CLK2PIK3CD
SCHEMBL1497533 0.80 DYRK1A (0.47) GPR119DYRK1APIM1CLK2PIK3CD

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
EP-2475375-A2 PI3 KINASE INHIBITORS AND USES THEREOF Avila Therapeutics, Inc. (US) 2012-07-18 EP disclosed
US-20110230476-A1 PI3 KINASE INHIBITORS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2011-09-22 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-20110230476-A1 PI3 KINASE INHIBITORS AND USES THEREOF PIK3CA, PIK3CB, PIK3C2B GPR119 997/4885DYRK1A 900/4885PIM1 117/4885

“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.