SCHEMBL17345852

SCHEMBL17345852

CN1CCOC(C)(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.37
▸ OPRM1 P35372 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ CRBN Q96SW2 1/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ BRD2 P25440 1/20 0.30

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
SCHEMBL12612290 0.87 BRD4 (0.37) LMNAOPRM1SIGMAR1BRD4BRD2
SCHEMBL13003396 0.76 — —
SCHEMBL18650812 0.74 LMNA (0.30) LMNA
SCHEMBL17342257 0.72 PIK3CD (0.39) —
SCHEMBL22511149 0.71 SIGMAR1 (0.36) SIGMAR1
SCHEMBL22450108 0.70 KDM4E (0.32) LMNA
SCHEMBL22304568 0.70 KDM4E (0.31) LMNA
SCHEMBL20551485 0.69 KDM4E (0.30) LMNA
SCHEMBL22511151 0.67 ALDH1A1 (0.39) LMNA
SCHEMBL22055778 0.67 PIK3CD (0.46) OPRM1SIGMAR1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023015199-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2023-02-09 — — WO disclosed
WO-2017049068-A1 HETEROARYL COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2017-03-23 — — WO disclosed
US-20170081317-A1 HETEROARYL COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2017-03-23 — — US disclosed
US-9382265-B2 Oxazolidone compound, preparing method and application thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2016-07-05 — — US disclosed
US-20150361091-A1 OXAZOLIDONE COMPOUND, PREPARING METHOD AND APPLICATION THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2015-12-17 — — 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-20170081317-A1 HETEROARYL COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF IRAK2, IRAK3, IRAK1 LMNA 1351/4885OPRM1 4045/4885SIGMAR1 3383/4885
US-20150361091-A1 OXAZOLIDONE COMPOUND, PREPARING METHOD AND APPLICATION THEREOF CYP3A43, CYP2C9, F2 LMNA 1739/4885OPRM1 9/4885SIGMAR1 443/4885

“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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