SCHEMBL22551892

SCHEMBL22551892

CN1CC2(C1)CN(c1cccc(CN)n1)C2

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 4/20 0.38
HTR3E A5X5Y0 3/20 0.38
HTR3B O95264 3/20 0.38
HTR3D Q70Z44 3/20 0.38
HTR3C Q8WXA8 3/20 0.38
PDE10A Q9Y233 7/20 0.37
ALDH1A1 P00352 4/20 0.35
HPGD P15428 4/20 0.35
HSD17B10 Q99714 4/20 0.35
CYP1A2 P05177 1/20 0.35
TSHR P16473 2/20 0.34
HIF1A Q16665 2/20 0.34
CYP2D6 P10635 1/20 0.34
CCR6 P51684 1/20 0.34
TRPV3 Q8NET8 2/20 0.34
IRAK4 Q9NWZ3 2/20 0.33
USP2 O75604 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
SCHEMBL30385235 1.00 HTR3A (0.38) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL21730229 0.90 PDE10A (0.39) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL30385308 0.90 PDE10A (0.39) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL21722602 0.81 HTR3A (0.60) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL22551836 0.80 PDE10A (0.36) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL30880813 0.80 PDE10A (0.36) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL23774619 0.76 PDE10A (0.47) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL2456126 0.75 PDE10A (0.55) PDE10ATRPV3
SCHEMBL21730384 0.75 PDE10A (0.51) PDE10ATRPV3
SCHEMBL22552024 0.75 PDE10A (0.38) HTR3AHTR3EHTR3BHTR3DHTR3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2023-05-04 US disclosed
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2023-05-04 US disclosed
US-11571420-B2 Pyrazine compounds and uses thereof DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-02-07 US disclosed
US-20210251989-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2021-08-19 US disclosed
US-10898481-B2 Pyrazine compounds and uses thereof DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2021-01-26 US disclosed
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2020-10-22 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-10898481-B2 Pyrazine compounds and uses thereof ADORA2A, ADORA2B, ADORA1 HTR3A 235/4885HTR3E 398/4885HTR3B 298/4885
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 HTR3A 235/4885HTR3E 398/4885HTR3B 298/4885
US-11571420-B2 Pyrazine compounds and uses thereof ADORA2A, ADORA2B, ADORA1 HTR3A 235/4885HTR3E 398/4885HTR3B 298/4885
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 HTR3A 235/4885HTR3E 398/4885HTR3B 298/4885
US-20210251989-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 HTR3A 235/4885HTR3E 398/4885HTR3B 298/4885

“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.