SCHEMBL4991478

SCHEMBL4991478

Cc1ccc(N2CCN(c3cncc(-c4cc(C)cc(C)c4)n3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 4/20 0.43
RAD52 P43351 1/20 0.43
CLK2 P49760 1/20 0.41
CLK3 P49761 1/20 0.41
DYRK1A Q13627 1/20 0.41
C1S P09871 1/20 0.41
DHFR P00374 2/20 0.41
PIM2 Q9P1W9 3/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
DGAT1 O75907 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PIM1 P11309 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
SCHEMBL4992145 0.91 MAPT (0.48) CHEK1RAD52CLK2CLK3DYRK1A
SCHEMBL4995501 0.90 MAPT (0.49) CHEK1RAD52PIM2KDM4EALDH1A1
SCHEMBL4987930 0.90 RAD52 (0.42) CHEK1RAD52CLK2CLK3DYRK1A
SCHEMBL5000712 0.90 CHEK1 (0.52) CHEK1RAD52CLK2CLK3DYRK1A
SCHEMBL5003034 0.88 PIM2 (0.48) CHEK1RAD52CLK2CLK3DYRK1A
SCHEMBL4996226 0.86 CHEK1 (0.48) CHEK1RAD52PIM2KDM4EALDH1A1
SCHEMBL5000886 0.86 MAPT (0.46) RAD52CLK2CLK3DYRK1ADHFR
SCHEMBL4994661 0.84 ACVR1 (0.42) RAD52MAPT
SCHEMBL4995137 0.84 MEN1 (0.48) CHEK1CYP11B1CYP11B2DGAT1KDM4E
SCHEMBL5003465 0.84 MEN1 (0.48) CHEK1CYP11B1CYP11B2DGAT1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 US claimed
US-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 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 (1 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-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases PRNP, PSEN1, PPP5C CHEK1 1668/4885RAD52 1663/4885CLK2 1374/4885

“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.