SCHEMBL21931902

SCHEMBL21931902

Nc1ncc(Cl)nc1C1CN(C(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
MAPKAPK2 P49137 9/20 0.35
GRM5 P41594 2/20 0.35
ALDH1A1 P00352 1/20 0.33
ATR Q13535 1/20 0.32
PDE10A Q9Y233 4/20 0.32
KRAS P01116 1/20 0.31
SIRT6 Q8N6T7 1/20 0.31

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
SCHEMBL29420649 0.80 MAPKAPK2 (0.41) MAPKAPK2PDE10A
SCHEMBL21331319 0.80 MAPKAPK2 (0.41) MAPKAPK2PDE10A
SCHEMBL21931895 0.79 GPR119 (0.37) PIM1PIM3PIM2
SCHEMBL31416583 0.77 MAPKAPK2 (0.40) PIM1PIM3PIM2MAPKAPK2GRM5
SCHEMBL30045747 0.76 MAPKAPK2 (0.44) MAPKAPK2ALDH1A1
SCHEMBL21999413 0.72 MAPKAPK2 (0.38) MAPKAPK2GRM5
SCHEMBL2596088 0.72 ABL1 (0.38) PDE10A
SCHEMBL1304590 0.71 PDE10A (0.43) PDE10A
Hydrochloric Acid SCHEMBL21931904 0.71 MAPKAPK2 (0.37) MAPKAPK2GRM5
SCHEMBL25255898 0.70 SCD5 (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11926616-B2 Aminopyrazine diol compounds as PI3K-γ inhibitors INCYTE CORPORATION (US) 2024-03-12 US disclosed
US-20220411383-A1 AMINOPYRAZINE DERIVATIVES AS PI3K-y INHIBITORS INCYTE CORPORATION 2022-12-29 US disclosed
US-20220213065-A1 AMINOPYRAZINE DIOL COMPOUNDS AS PI3K-y INHIBITORS INCYTE CORPORATION 2022-07-07 US disclosed
EP-3762368-B1 AMINOPYRAZINE DIOL COMPOUNDS AS PI3K-Y INHIBITORS INCYTE CORP (US) 2022-01-26 EP disclosed
US-11161838-B2 Heterocyclic derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2021-11-02 US disclosed
US-11046658-B2 Aminopyrazine derivatives as PI3K-γ inhibitors INCYTE CORPORATION (US) 2021-06-29 US disclosed
US-20200339542-A1 AMINOPYRAZINE DIOL COMPOUNDS AS PI3K-y INHIBITORS INCYTE CORPORATION 2020-10-29 US disclosed
WO-2020102150-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2020-05-22 WO disclosed
US-20200148671-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2020-05-14 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 (7 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-11161838-B2 Heterocyclic derivatives as PI3K inhibitors PIK3CD, PIK3R5, PIK3CG PIM1 556/4885PIM3 519/4885PIM2 551/4885
US-11046658-B2 Aminopyrazine derivatives as PI3K-γ inhibitors PIK3R5, PIK3CD, PIK3CG PIM1 655/4885PIM3 704/4885PIM2 479/4885
US-20220213065-A1 AMINOPYRAZINE DIOL COMPOUNDS AS PI3K-y INHIBITORS PIK3CD, PIK3R5, PIK3CG PIM1 770/4885PIM3 765/4885PIM2 559/4885
US-20200148671-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS PIK3CD, PIK3R5, PIK3CG PIM1 556/4885PIM3 519/4885PIM2 551/4885
US-11926616-B2 Aminopyrazine diol compounds as PI3K-γ inhibitors PIK3CD, PIK3R5, PIK3CG PIM1 737/4885PIM3 784/4885PIM2 571/4885
US-20220411383-A1 AMINOPYRAZINE DERIVATIVES AS PI3K-y INHIBITORS PIK3R5, PIK3CD, PIK3CG PIM1 769/4885PIM3 728/4885PIM2 527/4885
US-20200339542-A1 AMINOPYRAZINE DIOL COMPOUNDS AS PI3K-y INHIBITORS PIK3CD, PIK3R5, PIK3CG PIM1 770/4885PIM3 765/4885PIM2 559/4885

“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.