SCHEMBL2014561

SCHEMBL2014561

CCc1cc(C(C)Nc2ncnc3[nH]cnc23)c(-c2cccc(F)c2)c2ncccc12

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.62
BCL2 P10415 1/20 0.45
AXL P30530 2/20 0.43
MERTK Q12866 2/20 0.43
PIK3CG P48736 3/20 0.42
DYRK1A Q13627 1/20 0.40
MAP4K4 O95819 1/20 0.39
PIK3R1 P27986 1/20 0.38
PIK3CB P42338 1/20 0.38

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
Trifluoroacetic Acid SCHEMBL2052104 0.94 PIK3CD (0.56) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL12403852 0.90 PIK3CD (0.65) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL2014203 0.90 PIK3CD (0.65) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL12403851 0.90 PIK3CD (0.65) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL2014146 0.89 PIK3CD (0.64) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL12631307 0.89 PIK3CD (0.64) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL2015186 0.88 PIK3CD (0.79) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL2016845 0.86 PIK3CD (0.62) PIK3CDBCL2AXLMERTKPIK3CG
Trifluoroacetic Acid SCHEMBL2163783 0.83 PIK3CD (0.69) PIK3CDBCL2AXLMERTKPIK3CG
SCHEMBL2016212 0.83 PIK3CD (0.77) PIK3CDBCL2AXLMERTKPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680108-B2 Substituted fused aryl and heteroaryl derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2014-03-25 US claimed
US-20110183985-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2011-07-28 US claimed
WO-2011075630-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-06-23 WO claimed
US-8680108-B2 Substituted fused aryl and heteroaryl derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2014-03-25 US disclosed
US-8680108-B2 Substituted fused aryl and heteroaryl derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2014-03-25 US disclosed
US-20110183985-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2011-07-28 US disclosed
US-20110183985-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2011-07-28 US disclosed
WO-2011075630-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-06-23 WO disclosed
WO-2011075630-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-06-23 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-20110183985-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS PIK3R1, PIK3R3, PIK3R2 PIK3CD 13/4885BCL2 1174/4885AXL 508/4885

“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.