SCHEMBL2718686

SCHEMBL2718686

CC(N)c1cnc2ccc(F)cc2c1-c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.45
PIK3CG P48736 10/20 0.45
PIK3CB P42338 9/20 0.45
PIK3CA P42336 8/20 0.45
METAP2 P50579 1/20 0.43
METAP1 P53582 1/20 0.43
CBFB Q13951 1/20 0.43
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
LMNA P02545 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SLC2A1 P11166 1/20 0.36
FFAR1 O14842 1/20 0.36

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
SCHEMBL2721156 0.85 CLK1 (0.41) PIK3CDPIK3CGPIK3CBPIK3CA
SCHEMBL2719397 0.83 METAP1 (0.41) METAP1LMNAL3MBTL1
SCHEMBL10200560 0.83 METAP1 (0.41) METAP1LMNAL3MBTL1
SCHEMBL6121710 0.82 PIK3CD (0.58) PIK3CDPIK3CGPIK3CBPIK3CAMETAP2
SCHEMBL2720782 0.79 CCR1 (0.38) PIK3CDPIK3CGPIK3CBPIK3CACBFB
SCHEMBL2718744 0.79 GRM5 (0.40) PIK3CDPIK3CGPIK3CBPIK3CALMNA
SCHEMBL10199790 0.79 GRM5 (0.40) PIK3CDPIK3CGPIK3CBPIK3CALMNA
SCHEMBL20061345 0.79 PIK3CD (0.53) PIK3CDPIK3CGPIK3CBPIK3CAMETAP2
SCHEMBL28565071 0.79 PIK3CD (0.53) PIK3CDPIK3CGPIK3CBPIK3CAMETAP2
SCHEMBL2718453 0.76 HPGDS (0.43) METAP2METAP1CBFBLMNAL3MBTL1

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-20140031355-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2014-01-30 US disclosed
US-20140031355-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2014-01-30 US disclosed
EP-2635565-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS Amgen Inc. (US) 2013-09-11 EP disclosed
WO-2012061696-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS AMGEN INC. (US) 2012-05-10 WO disclosed
WO-2012061696-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS AMGEN INC. (US) 2012-05-10 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-20140031355-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, SSB, MALT1 PIK3CD 1672/4885PIK3CG 2394/4885PIK3CB 1689/4885

“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.