SCHEMBL15875530

SCHEMBL15875530

O=C(O)COCCc1cnn[nH]1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.36
▸ CYP4A11 Q02928 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.36
▸ FFAR4 Q5NUL3 3/20 0.32

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
Hydrochloric Acid SCHEMBL28678114 0.98 CYP4F2 (0.36) CYP4F2CYP4A11HCAR2FFAR4
Trifluoroacetic Acid SCHEMBL15875621 0.91 HRH4 (0.35) CYP4F2CYP4A11HCAR2
SCHEMBL15875664 0.79 HCAR2 (0.32) HCAR2
SCHEMBL15875623 0.78 — —
SCHEMBL8773843 0.72 — —
SCHEMBL22316983 0.70 HCAR2 (0.30) HCAR2
SCHEMBL22315710 0.70 HCAR2 (0.30) HCAR2
SCHEMBL2006030 0.69 — —
Hydrochloric Acid SCHEMBL28701466 0.69 — —
Hydrochloric Acid SCHEMBL28701463 0.69 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113943274-A Amide compound and preparation method thereof 武汉人福创新药物研发中心有限公司 2022-01-18 — — CN disclosed
CN-113943295-A Pyrrolopyrimidines and their use 武汉人福创新药物研发中心有限公司 2022-01-18 — — CN disclosed
EP-2943494-B1 PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN LILLY CO ELI (US) 2017-02-22 — — EP disclosed
EP-2943494-B1 PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN LILLY CO ELI (US) 2017-02-22 — — EP disclosed
EP-2943494-A1 PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN Eli Lilly and Company (US) 2015-11-18 — — EP disclosed
US-8969555-B2 Bicyclic pyrimidine compounds ELI LILLY AND COMPANY (US) 2015-03-03 — — US disclosed
US-8969555-B2 Bicyclic pyrimidine compounds ELI LILLY AND COMPANY (US) 2015-03-03 — — US disclosed
US-20140200231-A1 Bicyclic Pyrimidine Compounds ELI LILLY AND COMPANY (US) 2014-07-17 — — US disclosed
WO-2014110000-A1 PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN ELI LILLY AND COMPANY (US) 2014-07-17 — — WO disclosed
WO-2014110000-A1 PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN ELI LILLY AND COMPANY (US) 2014-07-17 — — 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 (1 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-20140200231-A1 Bicyclic Pyrimidine Compounds ENPP2, HAX1, NUDT1 CYP4F2 924/4885CYP4A11 1405/4885HCAR2 145/4885

“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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