SCHEMBL20874956

SCHEMBL20874956

CC(C)(C)OC(=O)N(C(=O)O)c1ncnc2c1c(Br)nn2C1CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.41
▸ JAK3 P52333 4/20 0.41
▸ JAK1 P23458 3/20 0.41
▸ KDR P35968 5/20 0.37
▸ SRC P12931 4/20 0.37
▸ EGFR P00533 2/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ HCK P08631 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ MTOR P42345 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ EPHB4 P54760 1/20 0.37
▸ PRKDC P78527 1/20 0.37
▸ PI4KB Q9UBF8 1/20 0.37
▸ RET P07949 6/20 0.36
▸ LCK P06239 2/20 0.33
▸ CDC7 O00311 1/20 0.33
▸ PLK4 O00444 1/20 0.33

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
SCHEMBL26725853 0.95 JAK2 (0.43) JAK2JAK3JAK1KDRSRC
SCHEMBL27217948 0.77 SRC (0.39) SRCEGFRABL1
SCHEMBL20692747 0.75 SRC (0.39) SRCEGFRABL1
SCHEMBL27217916 0.73 SRC (0.38) SRCEGFRABL1RET
SCHEMBL27217986 0.72 LCK (0.35) KDRSRCRETLCKVCP
SCHEMBL19492062 0.71 RET (0.62) JAK2JAK3JAK1KDRSRC
SCHEMBL19492063 0.71 RET (0.62) JAK2JAK3JAK1KDRSRC
SCHEMBL19492064 0.71 RET (0.62) JAK2JAK3JAK1KDRSRC
SCHEMBL20875035 0.71 PDPK1 (0.33) JAK3JAK1MKNK2
SCHEMBL30813452 0.71 SRC (0.39) SRCEGFRABL1MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339954-A1 Heterocyclic Compounds as RET Kinase Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-10-26 — — US disclosed
US-11548896-B2 Heterocyclic compounds as RET kinase inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-01-10 — — US disclosed
EP-3960180-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS Cancer Research Technology Limited (GB) 2022-03-02 — — EP disclosed
EP-3442980-B1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS CANCER RESEARCH TECH LTD (GB) 2021-06-09 — — EP disclosed
US-20210155628-A1 Heterocyclic Compounds as RET Kinase Inhibitors CANCER RESEARCH TECH LTD (GB) 2021-05-27 — — US disclosed
US-10954241-B2 Heterocyclic compounds as ret kinase inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-03-23 — — US disclosed
US-20190106425-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-04-11 — — US disclosed
US-20160122321-A1 Carboxamide Compounds and Methods for Using the Same MIDCAP FINANCIAL TRUST 2016-05-05 — — 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 (6 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-20210155628-A1 Heterocyclic Compounds as RET Kinase Inhibitors RET, REL, BCR JAK2 44/4885JAK3 114/4885JAK1 193/4885
US-20160122321-A1 Carboxamide Compounds and Methods for Using the Same PC, AK2, PRKAA2 JAK2 343/4885JAK3 2387/4885JAK1 2237/4885
US-20190106425-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS RET, REL, BCR JAK2 44/4885JAK3 114/4885JAK1 193/4885
US-11548896-B2 Heterocyclic compounds as RET kinase inhibitors RET, REL, BCR JAK2 44/4885JAK3 114/4885JAK1 193/4885
US-20230339954-A1 Heterocyclic Compounds as RET Kinase Inhibitors RET, REL, BCR JAK2 44/4885JAK3 114/4885JAK1 193/4885
US-10954241-B2 Heterocyclic compounds as ret kinase inhibitors RET, REL, BCR JAK2 44/4885JAK3 114/4885JAK1 193/4885

“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.

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