SCHEMBL30205239

SCHEMBL30205239

C=CC(=O)N1CCN([C@@H](CC2CC2)c2ccc(CCNc3ncc4c(n3)N(CC)C(=O)OC4)cc2)CC1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 20/20 0.79
▸ IDH2 P48735 17/20 0.79

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
SCHEMBL20289618 0.94 IDH1 (0.82) IDH1IDH2
Crelosidenib SCHEMBL29765374 0.88 IDH1 (1.00) IDH1IDH2
Crelosidenib SCHEMBL29427547 0.88 IDH1 (1.00) IDH1IDH2
Crelosidenib SCHEMBL20270338 0.88 IDH1 (1.00) IDH1IDH2
Crelosidenib SCHEMBL20289768 0.88 IDH1 (1.00) IDH1IDH2
Crelosidenib SCHEMBL20270341 0.88 IDH1 (1.00) IDH1IDH2
Crelosidenib SCHEMBL20271764 0.88 IDH1 (1.00) IDH1IDH2
Crelosidenib SCHEMBL21799142 0.86 IDH1 (0.94) IDH1IDH2
SCHEMBL22591188 0.86 IDH1 (0.81) IDH1IDH2
SCHEMBL24170447 0.86 IDH1 (0.94) IDH1IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746115-B2 Solid forms of 7-[[(1S)-1-[4-[(1S)-2-cyclopropyl-1-(4-prop-2-enoylpiperazin-1-yl)ethyl]phenyl]ethyl]amino]-1-ethyl-4H-pyrimido[4,5-d][1,3]oxazin-2-one ELI LILLY AND COMPANY (US) 2023-09-05 — — US disclosed
US-20230061806-A1 SOLID FORMS OF 7-[[(1S)-1-[4-[(1S)-2-CYCLOPROPYL-1-(4-PROP-2-ENOYLPIPERAZIN-1-YL)ETHYL]PHENYL]ETHYL]AMINO]-1-ETHYL-4H-PYRIMIDO[4,5-D][1,3]OXAZIN-2-ONE CURIA INDIANA, LLC 2023-03-02 — — 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 (2 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-11746115-B2 Solid forms of 7-[[(1S)-1-[4-[(1S)-2-cyclopropyl-1-(4-prop-2-enoylpiperazin-1-yl)ethyl]phenyl]ethyl]amino]-1-ethyl-4H-pyrimido[4,5-d][1,3]oxazin-2-one H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, VHL, CYP24A1 IDH1 250/4885IDH2 561/4885
US-20230061806-A1 SOLID FORMS OF 7-[[(1S)-1-[4-[(1S)-2-CYCLOPROPYL-1-(4-PROP-2-ENOYLPIPERAZIN-1-YL)ETHYL]PHENYL]ETHYL]AMINO]-1-ETHYL-4H-PYRIMIDO[4,5-D][1,3]OXAZIN-2-ONE H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, VHL, CYP24A1 IDH1 250/4885IDH2 561/4885

“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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