SCHEMBL21174789

SCHEMBL21174789

CCC(NC(=O)O)c1nc2cccc(C#CCO)c2c(=O)n1C1CC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.60
PIK3CG P48736 11/20 0.60
PIK3R1 P27986 5/20 0.60
PIK3R2 O00459 5/20 0.48
PIK3CA P42336 5/20 0.44
KCNH2 Q12809 1/20 0.39
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
SCHEMBL21174714 0.92 PIK3CD (0.51) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174690 0.89 PIK3CD (0.54) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL16583340 0.88 PIK3CD (0.57) PIK3CDPIK3CGPIK3R1PIK3R2
SCHEMBL16583272 0.85 PIK3CD (0.46) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174761 0.84 PIK3CD (0.56) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL16583241 0.84 PIK3CD (0.51) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174765 0.84 PIK3CD (0.56) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174720 0.83 PIK3CD (0.60) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174812 0.81 PIK3CD (0.53) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174810 0.81 PIK3CD (0.53) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA

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
US-10751339-B2 Substituted aminopyrimidine compounds and methods of use SUNSHINE LAKE PHARMA CO., LTD. (CN) 2020-08-25 US disclosed
US-20190224197-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-07-25 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 (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-20190224197-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PIK3CA, PIK3R1, PIK3R3 PIK3CD 4/4885PIK3CG 8/4885PIK3R1 2/4885
US-10751339-B2 Substituted aminopyrimidine compounds and methods of use PIK3CA, PIK3CD, MYD88 PIK3CD 2/4885PIK3CG 6/4885PIK3R1 9/4885

“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.