SCHEMBL4994141

SCHEMBL4994141

CC(=O)c1cccc(-c2cncc(N3CCN(c4ccccn4)CC3)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
PIM2 Q9P1W9 8/20 0.51
HPGD P15428 2/20 0.50
PIM1 P11309 1/20 0.48
CSNK2A2 P19784 1/20 0.48
CSNK2A1 P68400 1/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPK1 P28482 1/20 0.47
SLC6A7 Q99884 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 2/20 0.46
GRM5 P41594 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL4996178 0.90 PIM2 (0.52) PIM2PIM1CSNK2A2CSNK2A1SLC6A7
SCHEMBL4997188 0.89 HRH3 (0.53) POLBALDH1A1MAPK1SLC6A7L3MBTL1
SCHEMBL4995128 0.86 PIM2 (0.55) PIM2PIM1CSNK2A2CSNK2A1MAPK1
SCHEMBL4997769 0.85 PIM2 (0.52) PIM2PIM1CSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL5003434 0.84 ACHE (0.57) POLBPIM2HPGDALDH1A1MAPK1
SCHEMBL5003397 0.83 SMN1; SMN2 (0.53) PIM2PIM1CSNK2A2CSNK2A1ALDH1A1
SCHEMBL3364833 0.82 PIM2 (0.68) PIM2PIM1CSNK2A2CSNK2A1
SCHEMBL4997412 0.81 KMT2A (0.55) PIM2HPGDALDH1A1MAPK1KDM4E
SCHEMBL5003444 0.81 DRD4 (0.49) POLBPIM2HPGDALDH1A1MAPK1
SCHEMBL5002971 0.81 PIM2 (0.50) PIM2HPGDPIM1CSNK2A2CSNK2A1

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 1 patent. 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

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 POLB 889/4885PIM2 1679/4885HPGD 1494/4885

“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.