SCHEMBL19900305

SCHEMBL19900305

Cc1nc(OC2CCC2)nc(OC2CCC2)c1Br

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 4/20 0.36
▸ TSHR P16473 2/20 0.35
▸ PTGS1 P23219 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ PIM2 Q9P1W9 1/20 0.31

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
SCHEMBL8388467 0.82 LRRK2 (0.36) LRRK2PTGS1
SCHEMBL19899806 0.79 LRRK2 (0.36) LRRK2PTGS1PIM1PIM2
SCHEMBL29732827 0.76 CHRM3 (0.36) —
SCHEMBL19900326 0.76 ALDH1A1 (0.36) LRRK2
SCHEMBL29732895 0.76 ALDH1A1 (0.36) LRRK2
SCHEMBL19900207 0.76 CHRM3 (0.36) —
SCHEMBL18005407 0.76 MEN1 (0.35) LRRK2
SCHEMBL19899762 0.72 MEN1 (0.32) —
SCHEMBL9862260 0.66 PDGFRB (0.36) LRRK2PTGS1
SCHEMBL22105478 0.66 FFAR4 (0.36) LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595250-B2 Substituted pyrimidine compounds as multifunctional radical quenchers and their uses ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2026-04-07 — — US disclosed
US-20220324841-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-10-13 — — US disclosed
US-11390605-B2 Substituted pyrimidine compounds as multifunctional radical quenchers and their uses ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-07-19 — — US disclosed
US-20210276979-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2021-09-09 — — US disclosed
WO-2018039077-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-03-01 — — WO disclosed
WO-2018039077-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-03-01 — — 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 (4 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-12595250-B2 Substituted pyrimidine compounds as multifunctional radical quenchers and their uses GSR, UQCRC1, TXNRD2 LRRK2 1228/4885TSHR 793/4885PTGS1 309/4885
US-20220324841-A1 THERAPEUTIC COMPOUNDS CFTR, F12, FURIN LRRK2 918/4885TSHR 835/4885PTGS1 1301/4885
US-20210276979-A1 THERAPEUTIC COMPOUNDS CFTR, F12, FURIN LRRK2 918/4885TSHR 835/4885PTGS1 1301/4885
US-11390605-B2 Substituted pyrimidine compounds as multifunctional radical quenchers and their uses DPYD, TYMP, NUDT1 LRRK2 2341/4885TSHR 2235/4885PTGS1 442/4885

“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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