SCHEMBL5847643

SCHEMBL5847643

O=C(O)[C@H]1CCOc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.41
ITGB2 P05107 1/20 0.40
ICAM1 P05362 1/20 0.40
ITGAL P20701 1/20 0.40
PTGDR2 Q9Y5Y4 6/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL29948201 1.00 SSTR4 (0.41) SSTR4ITGB2ICAM1ITGALPTGDR2
SCHEMBL30207743 1.00 SSTR4 (0.41) SSTR4ITGB2ICAM1ITGALPTGDR2
SCHEMBL769058 1.00 SSTR4 (0.41) SSTR4ITGB2ICAM1ITGALPTGDR2
SCHEMBL5847641 1.00 SSTR4 (0.41) SSTR4ITGB2ICAM1ITGALPTGDR2
SCHEMBL27833998 0.98 SSTR4 (0.40) SSTR4ITGB2ICAM1ITGALPTGDR2
Hydrochloric Acid SCHEMBL28001542 0.98 SSTR4 (0.40) SSTR4ITGB2ICAM1ITGALPTGDR2
Cyanate SCHEMBL27883107 0.92 PTGDR2 (0.41) PTGDR2
SCHEMBL7420482 0.90 NPC1 (0.40) SSTR4ITGB2ICAM1ITGALALDH1A1
SCHEMBL27675759 0.86 PTGDR2 (0.42) SSTR4PTGDR2SMN1; SMN2
SCHEMBL24075070 0.84 SSTR4 (0.40) SSTR4ITGB2ICAM1ITGALGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3897842-B1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2025-01-29 EP disclosed
CN-113490527-B Bicyclic derivatives 瑞士伊兰科动物保健有限公司 2024-10-25 CN disclosed
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2023-06-08 US disclosed
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2023-06-08 US disclosed
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2023-06-08 US disclosed
CN-115667221-A Substituted fused oxazines as insect repellent compounds 拜耳动物保健有限责任公司 2023-01-31 CN disclosed
US-20220064159-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2022-03-03 US disclosed
EP-3902798-A1 N-(4-(OXAZOL-5-YL)PHENYL)CHROMANE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS STIMULATORS OF THE PRODUCTION OF RETINAL PRECURSOR CELLS FOR THE TREATMENT OF NEURORETINAL DISEASES Endogena Therapeutics, Inc. (US) 2021-11-03 EP disclosed
EP-3897842-A1 BICYCLIC DERIVATIVES Elanco Tiergesundheit AG (CH) 2021-10-27 EP disclosed
CN-113490527-A Bicyclic derivatives 瑞士伊兰科动物保健有限公司 2021-10-08 CN disclosed
WO-2020140050-A1 N-(4-(OXAZOL-5-YL)PHENYL)CHROMANE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS STIMULATORS OF THE PRODUCTION OF RETINAL PRECURSOR CELLS FOR THE TREATMENT OF NEURORETINAL DISEASES ENDOGENA THERAPEUTICS, INC. (US) 2020-07-02 WO disclosed
WO-2020131631-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2020-06-25 WO disclosed
US-7034051-B2 Fused bicyclic carboxamide derivatives and methods of their use ADOLOR CORPORATION (US) 2006-04-25 US disclosed
WO-2005023799-A1 FUSED BICYCLIC CARBOXAMIDE DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2005-03-17 WO disclosed
US-20050054630-A1 Fused bicyclic carboxamide derivatives and methods of their use CUBIST PHARMACEUTICALS, INC. 2005-03-10 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 (3 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-20220064159-A1 BICYCLIC DERIVATIVES FABP3, CYCS, PIGS SSTR4 3439/4885ITGB2 772/4885ICAM1 1769/4885
US-20050054630-A1 Fused bicyclic carboxamide derivatives and methods of their use PAICS, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CPS1 SSTR4 2481/4885ITGB2 3950/4885ICAM1 4873/4885
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS H1-5, H1-10, H1-0 SSTR4 3943/4885ITGB2 3022/4885ICAM1 1726/4885

“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.