SCHEMBL5778692

SCHEMBL5778692

[CH2]n1cc2ccccc2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
GLA P06280 1/20 0.39
ACHE P22303 1/20 0.39
NQO2 P16083 1/20 0.37
SLC6A2 P23975 1/20 0.36
KDM4E B2RXH2 4/20 0.34
HDAC8 Q9BY41 1/20 0.34
NCF1 P14598 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CYP1A2 P05177 2/20 0.33
NOS2 P35228 1/20 0.33
BACE1 P56817 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
GAA P10253 1/20 0.33
GPR3 P46089 1/20 0.32
EGFR P00533 1/20 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
SCHEMBL27805790 0.73 MAPT (0.41) MAPTALDH1A1HPGDGLAACHE
SCHEMBL2011803 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
SCHEMBL160959 0.71 MAPT (0.53) MAPTALDH1A1HPGDGLAACHE
SCHEMBL11670105 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
SCHEMBL275534 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
SCHEMBL1861283 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
SCHEMBL18603280 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
SCHEMBL1728361 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
SCHEMBL14976437 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE
Hydrochloric Acid SCHEMBL28330949 0.71 MAPT (0.39) MAPTALDH1A1HPGDGLAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2024-06-04 US claimed
US-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2022-05-05 US claimed
CN-113166153-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2021-07-23 CN claimed
EP-3818063-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS Incyte Corporation (US) 2021-05-12 EP claimed
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2020-01-30 US claimed
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2024-06-04 US disclosed
CN-117304191-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2023-12-29 CN disclosed
US-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2022-05-05 US disclosed
US-11161850-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2021-11-02 US disclosed
CN-113166153-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2021-07-23 CN disclosed
EP-3818063-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS Incyte Corporation (US) 2021-05-12 EP disclosed
EP-3802514-A1 INHIBITORS OF OPLOPHORUS LUCIFERASE-DERIVED BIOLUMINESCENT COMPLEXES Promega Corporation (US) 2021-04-14 EP disclosed
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2020-01-30 US disclosed
CN-105669668-B Pyrido indazole or benzo pyrido indazole derivative and its synthetic method 上海大学 2018-03-06 CN disclosed
US-8741897-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2014-06-03 US disclosed
EP-1673088-A1 1,1,1- TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO¬2,3-C|PYRIDIN-2-YLMETHYL)PENTAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS GLUCOCORTICOID LIGANDS FOR THE TREATMENT OF INFLAMMATORY DISEASES AND DIABETES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2006-06-28 EP disclosed
US-20050176706-A1 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-08-11 US disclosed
WO-2005030213-A1 1,1,1-TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-04-07 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 (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-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS ADORA2A, ADORA2B, ADORA1 MAPT 3370/4885ALDH1A1 534/4885HPGD 996/4885
US-20050176706-A1 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions and uses thereof NR3C1, NR3C2, MC2R MAPT 236/4885ALDH1A1 3621/4885HPGD 1302/4885
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS ADORA2A, ADORA2B, ADORA1 MAPT 3370/4885ALDH1A1 534/4885HPGD 996/4885
US-11161850-B2 Fused pyrazine derivatives as A2A / A2B inhibitors ADORA2A, ADORA2B, ADORA1 MAPT 3370/4885ALDH1A1 534/4885HPGD 996/4885
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors ADORA2A, ADORA2B, ADORA1 MAPT 3370/4885ALDH1A1 534/4885HPGD 996/4885

“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.