SCHEMBL17962802

SCHEMBL17962802

CC(C)Cn1nc(-c2ccc3cc(O)ccc3c2)c2c(N)ncnc21

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.71
PRKDC P78527 13/20 0.71
PIK3CA P42336 11/20 0.71
PIK3CB P42338 11/20 0.71
PIK3CG P48736 11/20 0.71
SRC P12931 8/20 0.71
ABL1 P00519 6/20 0.71
EGFR P00533 4/20 0.71
HCK P08631 4/20 0.71
KDR P35968 4/20 0.71
MTOR P42345 4/20 0.71
EPHB4 P54760 4/20 0.71
PI4KB Q9UBF8 3/20 0.71
KCNH2 Q12809 1/20 0.62
FYN P06241 1/20 0.55

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
SCHEMBL17962875 0.85 SRC (0.63) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL17963685 0.85 SRC (0.74) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL17962849 0.83 SRC (0.71) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL2468132 0.83 SRC (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL17963667 0.83 SRC (0.62) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL17962876 0.83 SRC (0.62) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL17962835 0.82 KCNH2 (0.77) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL130611 0.82 PIK3CD (0.77) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL29781002 0.81 FYN (0.66) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL17962832 0.80 KCNH2 (0.66) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10632122-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases UNIVERSITY OF WASHINGTON (US) 2020-04-28 US disclosed
US-10632122-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases UNIVERSITY OF WASHINGTON (US) 2020-04-28 US disclosed
US-10350211-B2 Bumped kinase inhibitor compositions and methods for treating cancer UNIVERSITY OF WASHINGTON (US) 2019-07-16 US disclosed
US-10350211-B2 Bumped kinase inhibitor compositions and methods for treating cancer UNIVERSITY OF WASHINGTON (US) 2019-07-16 US disclosed
US-10307425-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases UNIVERSITY OF WASHINGTON (US) 2019-06-04 US disclosed
US-10307425-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases UNIVERSITY OF WASHINGTON (US) 2019-06-04 US disclosed
US-20180273537-A1 COMPOSITIONS AND METHODS FOR TREATING TOXOPLASMOSIS, CRYPTOSPORIDIOSIS AND OTHER APICOMPLEXAN PROTOZOAN RELATED DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-09-27 US disclosed
US-20180271871-A1 BUMPED KINASE INHIBITOR COMPOSITIONS AND METHODS FOR TREATING CANCER NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-09-27 US disclosed
EP-3250290-A1 COMPOSITIONS AND METHODS FOR TREATING TOXOPLASMOSIS, CRYPTOSPORIDIOSIS AND OTHER APICOMPLEXAN PROTOZOAN RELATED DISEASES University of Washington (US) 2017-12-06 EP disclosed
WO-2016123152-A1 COMPOSITIONS AND METHODS FOR TREATING TOXOPLASMOSIS, CRYPTOSPORIDIOSIS AND OTHER APICOMPLEXAN PROTOZOAN RELATED DISEASES UNIVERSITY OF WASHINGTON (US) 2016-08-04 WO disclosed
WO-2016123151-A1 BUMPED KINASE INHIBITOR COMPOSITIONS AND METHODS FOR TREATING CANCER UNIVERSITY OF WASHINGTON (US) 2016-08-04 WO disclosed
WO-2016123152-A1 COMPOSITIONS AND METHODS FOR TREATING TOXOPLASMOSIS, CRYPTOSPORIDIOSIS AND OTHER APICOMPLEXAN PROTOZOAN RELATED DISEASES UNIVERSITY OF WASHINGTON (US) 2016-08-04 WO disclosed
WO-2016123151-A1 BUMPED KINASE INHIBITOR COMPOSITIONS AND METHODS FOR TREATING CANCER UNIVERSITY OF WASHINGTON (US) 2016-08-04 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 (5 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-20180273537-A1 COMPOSITIONS AND METHODS FOR TREATING TOXOPLASMOSIS, CRYPTOSPORIDIOSIS AND OTHER APICOMPLEXAN PROTOZOAN RELATED DISEASES PNCK, TXK, CAMKK1 PIK3CD 143/4885PRKDC 136/4885PIK3CA 199/4885
US-10632122-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases PNCK, TXK, CAMKK1 PIK3CD 143/4885PRKDC 136/4885PIK3CA 199/4885
US-20180271871-A1 BUMPED KINASE INHIBITOR COMPOSITIONS AND METHODS FOR TREATING CANCER CHEK2, CHEK1, DCK PIK3CD 184/4885PRKDC 12/4885PIK3CA 49/4885
US-10350211-B2 Bumped kinase inhibitor compositions and methods for treating cancer CHEK2, CHEK1, DCK PIK3CD 184/4885PRKDC 12/4885PIK3CA 49/4885
US-10307425-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases PNCK, CAMKK1, CILK1 PIK3CD 147/4885PRKDC 116/4885PIK3CA 225/4885

“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.