SCHEMBL7078799

SCHEMBL7078799

Cc1ccnc(C(=O)CC(=O)c2cc(Cc3ccccc3)cc(-c3cncc(N4CCN(C)CC4)n3)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 5/20 0.51
DYRK1A Q13627 7/20 0.44
PIM1 P11309 1/20 0.43
CSNK2A2 P19784 1/20 0.43
CSNK2A1 P68400 1/20 0.43
KLKB1 P03952 2/20 0.39
KLK1 P06870 2/20 0.39
GSK3B P49841 2/20 0.38
PRKD1 Q15139 1/20 0.37
PRKD2 Q9BZL6 1/20 0.37
MET P08581 1/20 0.37
CHEK1 O14757 1/20 0.37
PLOD2 O00469 1/20 0.36
PLOD3 O60568 1/20 0.36
PLOD1 Q02809 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
SLC6A2 P23975 1/20 0.36
HRH2 P25021 1/20 0.36
HTR1D P28221 1/20 0.36

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
SCHEMBL7079196 0.91 PIM2 (0.45) PIM2DYRK1AKLKB1KLK1
SCHEMBL7667601 0.86 PIM2 (0.56) PIM2DYRK1APIM1CSNK2A2CSNK2A1
SCHEMBL7078896 0.83 PLOD2 (0.47) PLOD2PLOD3PLOD1ADRA2BADRA2C
SCHEMBL7077395 0.82 WNT3A (0.43) PIM2PIM1PLOD2
SCHEMBL7078776 0.81 CYP1A2 (0.42)
SCHEMBL7077255 0.79 MC4R (0.41)
SCHEMBL7078626 0.78 KAT6A (0.39)
SCHEMBL7078412 0.75 WNT3A (0.40)
SCHEMBL7081122 0.73 CYP19A1 (0.39)
SCHEMBL7077399 0.73 SMN1; SMN2 (0.38) PLOD2BRD4

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-20030229079-A1 1-(Aromatic- or heteroaromatic-substituted)-3-(heteroaromatic substituted)-1,3-propanediones and uses thereof PAYNE LINDA S (US) 2003-12-11 US claimed
US-20030229079-A1 1-(Aromatic- or heteroaromatic-substituted)-3-(heteroaromatic substituted)-1,3-propanediones and uses thereof PAYNE LINDA S (US) 2003-12-11 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-20030229079-A1 1-(Aromatic- or heteroaromatic-substituted)-3-(heteroaromatic substituted)-1,3-propanediones and uses thereof CYP2S1, IMPDH1, IDO1 PIM2 843/4885DYRK1A 2767/4885PIM1 309/4885

“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.