SCHEMBL21292738

SCHEMBL21292738

Nc1ncnc2c1c(Br)nn2[C@H]1CC[C@H](NC(=O)O)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 5/20 0.60
▸ JAK2 O60674 5/20 0.60
▸ JAK1 P23458 3/20 0.60
▸ BTK Q06187 7/20 0.50
▸ LCK P06239 4/20 0.50
▸ EGFR P00533 4/20 0.50
▸ ITK Q08881 3/20 0.50
▸ FYN P06241 2/20 0.50
▸ SRC P12931 2/20 0.50
▸ FER P16591 2/20 0.50
▸ BLK P51451 2/20 0.50
▸ ABL1 P00519 1/20 0.50
▸ ERBB2 P04626 1/20 0.50
▸ YES1 P07947 1/20 0.50
▸ LYN P07948 1/20 0.50
▸ HCK P08631 1/20 0.50
▸ FGR P09769 1/20 0.50
▸ CSK P41240 1/20 0.50
▸ TEC P42680 1/20 0.50
▸ BMX P51813 1/20 0.50

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
SCHEMBL21292635 1.00 JAK3 (0.60) JAK3JAK2JAK1BTKLCK
SCHEMBL19492067 0.89 RET (0.60) JAK3JAK2JAK1BTKLCK
SCHEMBL19492071 0.89 RET (0.60) JAK3JAK2JAK1BTKLCK
SCHEMBL16594430 0.86 RET (0.68) JAK3JAK2BTKLCKEGFR
SCHEMBL17267662 0.86 RET (0.68) JAK3JAK2BTKLCKEGFR
SCHEMBL28423335 0.86 RET (0.68) JAK3JAK2BTKLCKEGFR
SCHEMBL18642030 0.85 JAK2 (0.65) JAK3JAK2JAK1BTKLCK
SCHEMBL19492064 0.84 RET (0.62) JAK3JAK2JAK1BTKLCK
SCHEMBL19492063 0.84 RET (0.62) JAK3JAK2JAK1BTKLCK
SCHEMBL19492062 0.84 RET (0.62) JAK3JAK2JAK1BTKLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116938-A1 Heterocyclic Compounds as RET Kinase Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-04-11 — — US disclosed
US-11661423-B2 Heterocyclic compounds as RET kinase inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-05-30 — — US disclosed
EP-4104837-A2 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS Cancer Research Technology Limited (GB) 2022-12-21 — — EP disclosed
EP-3442535-B1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS CANCER RESEARCH TECH LTD (GB) 2022-06-01 — — EP disclosed
US-20210047334-A1 Heterocyclic Compounds as RET Kinase Inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-02-18 — — US disclosed
US-10844067-B2 Heterocyclic compounds as RET kinase inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2020-11-24 — — US disclosed
US-20190263819-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-08-29 — — 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 (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-11661423-B2 Heterocyclic compounds as RET kinase inhibitors RET, HIPK4, HIPK3 JAK3 73/4885JAK2 59/4885JAK1 126/4885
US-20190263819-A1 HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS RET, HIPK4, HIPK3 JAK3 73/4885JAK2 59/4885JAK1 126/4885
US-20240116938-A1 Heterocyclic Compounds as RET Kinase Inhibitors RET, HIPK4, HIPK3 JAK3 73/4885JAK2 59/4885JAK1 126/4885
US-20210047334-A1 Heterocyclic Compounds as RET Kinase Inhibitors RET, HIPK4, HIPK3 JAK3 73/4885JAK2 59/4885JAK1 126/4885
US-10844067-B2 Heterocyclic compounds as RET kinase inhibitors RET, HIPK4, HIPK3 JAK3 73/4885JAK2 59/4885JAK1 126/4885

“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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