SCHEMBL3702647

SCHEMBL3702647

O[C@@H](CCl)c1ccc(F)cn1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APLNR P35414 5/20 0.45
SIGMAR1 Q99720 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
DRD2 P14416 1/20 0.35
GRIN2B Q13224 10/20 0.35
GRIN1 Q05586 6/20 0.35
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL20832717 1.00 APLNR (0.45) APLNRSIGMAR1KDM4ECYP1A2GAA
SCHEMBL30218199 0.82 APLNR (0.50) APLNRGRIN2BGRIN1
SCHEMBL22585597 0.82 APLNR (0.50) APLNRGRIN2BGRIN1
SCHEMBL31489711 0.82 APLNR (0.50) APLNRGRIN2BGRIN1
SCHEMBL31392878 0.82 APLNR (0.50) APLNRGRIN2BGRIN1
SCHEMBL30318694 0.82 APLNR (0.46) APLNRSIGMAR1KDM4ECYP1A2GAA
SCHEMBL29115176 0.82 APLNR (0.46) APLNRSIGMAR1KDM4ECYP1A2GAA
SCHEMBL30085317 0.81 APLNR (0.49) APLNRKDM4EDRD2GRIN2BGRIN1
SCHEMBL20470389 0.81 APLNR (0.49) APLNRKDM4EDRD2GRIN2BGRIN1
SCHEMBL20832723 0.78 BRD4 (0.37) APLNRGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2024-07-16 US disclosed
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2024-07-16 US disclosed
US-11357757-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2022-06-14 US disclosed
US-20220133703-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2022-05-05 US disclosed
EP-3681872-B1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2021-11-17 EP disclosed
US-20210030731-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2021-02-04 US disclosed
CN-111315726-A Heteroaryl substituted β -hydroxyethylamines for the treatment of hyperglycemia 阿托基公司 2020-06-19 CN disclosed
WO-2019053427-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2019-03-21 WO disclosed
WO-2012064269-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF Αβ-RELATED DISEASES ASTRAZENECA AB (SE) 2012-05-18 WO disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 US disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 US disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 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 (5 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-20220133703-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA SLC5A2, SLC5A1, GPR119 APLNR 2689/4885SIGMAR1 1007/4885KDM4E 943/4885
US-11357757-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia SLC5A2, SLC5A1, GPR119 APLNR 2689/4885SIGMAR1 1007/4885KDM4E 943/4885
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases APP, BACE1, PSEN1 APLNR 2421/4885SIGMAR1 2645/4885KDM4E 4725/4885
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia SLC5A2, SLC5A1, GPR119 APLNR 2689/4885SIGMAR1 1007/4885KDM4E 943/4885
US-20210030731-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA SLC5A2, SLC5A1, GPR119 APLNR 2689/4885SIGMAR1 1007/4885KDM4E 943/4885

“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.