SCHEMBL2011285

SCHEMBL2011285

CC(Nc1ncnc2[nH]cnc12)c1cc(Cl)c2cccnc2c1-c1ccccc1F

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.57
DYRK1A Q13627 1/20 0.43
PIK3R2 O00459 2/20 0.42
PIK3CG P48736 2/20 0.42
BCL2 P10415 1/20 0.41
AXL P30530 1/20 0.38
MERTK Q12866 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
EGFR P00533 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
Trifluoroacetic Acid SCHEMBL2163739 0.93 PIK3CD (0.51) PIK3CDDYRK1APIK3R2PIK3CGBCL2
SCHEMBL2016979 0.90 PIK3CD (0.59) PIK3CDDYRK1APIK3R2PIK3CGBCL2
SCHEMBL2015186 0.85 PIK3CD (0.79) PIK3CDDYRK1APIK3CGBCL2AXL
SCHEMBL2016174 0.83 PIK3CD (0.54) PIK3CDDYRK1APIK3R2PIK3CGEGFR
Trifluoroacetic Acid SCHEMBL2163783 0.79 PIK3CD (0.69) PIK3CDPIK3CGBCL2AXLMERTK
SCHEMBL2011286 0.79 PIK3CD (0.40) PIK3CDDYRK1AL3MBTL1ADAMTS5NPC1
SCHEMBL12631373 0.78 PIK3CD (0.49) PIK3CDPIK3R2BCL2L3MBTL1NPC1
SCHEMBL2017408 0.78 PIK3CD (0.64) PIK3CDPIK3CGBCL2AXLMERTK
SCHEMBL12403851 0.78 PIK3CD (0.65) PIK3CDDYRK1APIK3CGBCL2AXL
SCHEMBL12403852 0.78 PIK3CD (0.65) PIK3CDDYRK1APIK3CGBCL2AXL

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 10 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-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
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

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 13/4885DYRK1A 646/4885PIK3R2 3/4885

“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.