SCHEMBL19732673

SCHEMBL19732673

CC1(C)CCC(n2nc(C(=O)O)c3c(N)ncnc32)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 20/20 0.63
CDC7 O00311 1/20 0.47
PLK4 O00444 1/20 0.47
DYRK3 O43781 1/20 0.47
JAK2 O60674 1/20 0.47
PRKD3 O94806 1/20 0.47
MAP4K4 O95819 1/20 0.47
NTRK1 P04629 1/20 0.47
INSR P06213 1/20 0.47
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47
CDK1 P06493 1/20 0.47
ROS1 P08922 1/20 0.47
SRC P12931 1/20 0.47
FER P16591 1/20 0.47
PRKACA P17612 1/20 0.47
RPS6KB1 P23443 1/20 0.47
CDK2 P24941 1/20 0.47
MARK3 P27448 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL19732733 0.88 RET (0.62) RETCDC7PLK4DYRK3JAK2
SCHEMBL19732675 0.88 RET (0.62) RET
SCHEMBL19303914 0.86 RET (0.64) RET
SCHEMBL19732705 0.86 RET (0.61) RET
SCHEMBL29588931 0.85 RET (0.60) RETCDC7PLK4DYRK3JAK2
SCHEMBL19732745 0.85 RET (0.63) RET
SCHEMBL29589208 0.81 RET (0.57) RETCDC7PLK4DYRK3JAK2
SCHEMBL29589133 0.81 RET (0.61) RETCDC7PLK4DYRK3JAK2
SCHEMBL19732645 0.80 SRC (0.68) RETCDC7PLK4DYRK3JAK2
SCHEMBL19751413 0.78 RET (0.59) RET

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-11236096-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-02-01 US disclosed
EP-3260454-B1 CONDENSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2021-06-09 EP disclosed
US-11014930-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-05-25 US disclosed
US-10981920-B2 2021-04-20 US disclosed
US-10787457-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-09-29 US disclosed
US-20200270260-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-08-27 US disclosed
US-20200270261-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-08-27 US disclosed
CN-108026101-B Fused pyrimidine compound or salt thereof 大鹏药品工业株式会社 2020-06-26 CN disclosed
US-20190092776-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-03-28 US disclosed
US-10233189-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-03-19 US disclosed
US-10179788-B2 2019-01-15 US disclosed
US-20180009817-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2018-01-11 US disclosed
EP-3260454-A1 CONDENSED PYRIMIDINE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2017-12-27 EP 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 (10 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-11236096-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-10179788-B2 RET, GFRA1, GFRA2 RET 1/4885CDC7 1190/4885PLK4 3816/4885
US-10233189-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-10787457-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-20180009817-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-11014930-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-20200270260-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-10981920-B2 RET, GFRA1, GFRA2 RET 1/4885CDC7 1190/4885PLK4 3816/4885
US-20200270261-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885
US-20190092776-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 RET 1/4885CDC7 891/4885PLK4 3306/4885

“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.